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阿哌沙班CAS号: 503612-47-3 EC号: 639-684-6分子式: C25H25N5O4 分子量: 459.51IUPAC Name: 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamideSMILES: COC1=CC=C(C=C1)N2C3=C(CCN(C3=O)C4=CC=C(C=C4)N5CCCCC5=O)C(=N2)C(=O)NInChIKey: QNZCBYKSOIHPEH-UHFFFAOYSA-NInChI: 1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)
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奥米沙班CAS号: 193153-04-7分子式: C25H28N4O4 分子量: 448.53IUPAC Name: methyl (2R,3R)-2-[(3-carbamimidoylphenyl)methyl]-3-[[4-(1-oxidopyridin-1-ium-4-yl)benzoyl]amino]butanoateSMILES: CC(C(CC1=CC(=CC=C1)C(=N)N)C(=O)OC)NC(=O)C2=CC=C(C=C2)C3=CC=[N+](C=C3)[O-]InChIKey: PFGVNLZDWRZPJW-OPAMFIHVSA-NInChI: 1S/C25H26N4O4/c1-16(22(25(31)33-2)15-17-4-3-5-21(14-17)23(26)27)28-24(30)20-8-6-18(7-9-20)19-10-12-29(32)13-11-19/h3-14,16,22H,15H2,1-2H3,(H3,26,27)(H,28,30)/t16-,22-/m1/s1
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5-R-利伐沙班CAS号: 865479-71-6 Compound CID : 11524901分子式: C19H18ClN3O5S 分子量: 435.88IUPAC Name: 5-chloro-N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamideSMILES: C1COCC(=O)N1C2=CC=C(C=C2)N3CC(OC3=O)CNC(=O)C4=CC=C(S4)ClInChIKey: KGFYHTZWPPHNLQ-CQSZACIVSA-NInChI: 1S/C19H18ClN3O5S/c20-16-6-5-15(29-16)18(25)21-9-14-10-23(19(26)28-14)13-3-1-12(2-4-13)22-7-8-27-11-17(22)24/h1-6,14H,7-11H2,(H,21,25)/t14-/m1/s1
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利伐沙班分子式: C19H18ClN3O5S 分子量: 435.88IUPAC Name: 5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamideSMILES: C1COCC(=O)N1C2=CC=C(C=C2)N3CC(OC3=O)CNC(=O)C4=CC=C(S4)ClInChIKey: KGFYHTZWPPHNLQ-AWEZNQCLSA-NInChI: 1S/C19H18ClN3O5S/c20-16-6-5-15(29-16)18(25)21-9-14-10-23(19(26)28-14)13-3-1-12(2-4-13)22-7-8-27-11-17(22)24/h1-6,14H,7-11H2,(H,21,25)/t14-/m0/s1
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2-氯噻吩-5-甲酸CAS号: 24065-33-6 EC号: 480-060-6, 607-311-6分子式: C5H3ClO2S 分子量: 162.59IUPAC Name: 5-chlorothiophene-2-carboxylic acidSMILES: C1=C(SC(=C1)Cl)C(=O)OInChIKey: QZLSBOVWPHXCLT-UHFFFAOYSA-NInChI: 1S/C5H3ClO2S/c6-4-2-1-3(9-4)5(7)8/h1-2H,(H,7,8)
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依度沙班CAS号: 480449-70-5分子式: C24H30ClN7O4S 分子量: 548.06IUPAC Name: N'-(5-chloropyridin-2-yl)-N-[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carbonyl)amino]cyclohexyl]oxamideSMILES: CN1CCC2=C(C1)SC(=N2)C(=O)NC3CC(CCC3NC(=O)C(=O)NC4=NC=C(C=C4)Cl)C(=O)N(C)CInChIKey: HGVDHZBSSITLCT-JLJPHGGASA-NInChI: See more
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甲磺酸加贝酯CAS号: 56974-61-9分子式: C16H23N3O4·CH4O3S 分子量: 417.48IUPAC Name: ethyl 4-[6-(diaminomethylideneamino)hexanoyloxy]benzoate;methanesulfonic acidSMILES: CCOC(=O)C1=CC=C(C=C1)OC(=O)CCCCCN=C(N)N.CS(=O)(=O)OInChIKey: DNTNDFLIKUKKOC-UHFFFAOYSA-NInChI: 1S/C16H23N3O4.CH4O3S/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18;1-5(2,3)4/h7-10H,2-6,11H2,1H3,(H4,17,18,19);1H3,(H,2,3,4)
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贝曲西班CAS号: 330942-05-7分子式: C23H22ClN5O3 分子量: 451.91IUPAC Name: N-(5-chloropyridin-2-yl)-2-[[4-(N,N-dimethylcarbamimidoyl)benzoyl]amino]-5-methoxybenzamideSMILES: CN(C)C(=N)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)OC)C(=O)NC3=NC=C(C=C3)ClInChIKey: XHOLNRLADUSQLD-UHFFFAOYSA-NInChI: 1S/C23H22ClN5O3/c1-29(2)21(25)14-4-6-15(7-5-14)22(30)27-19-10-9-17(32-3)12-18(19)23(31)28-20-11-8-16(24)13-26-20/h4-13,25H,1-3H3,(H,27,30)(H,26,28,31)
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依多沙班对甲苯磺酸盐一水合物CAS号: 1229194-11-9分子式: C31H40ClN7O8S2 分子量: 738.3IUPAC Name: N'-(5-chloropyridin-2-yl)-N-[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carbonyl)amino]cyclohexyl]oxamide;4-methylbenzenesulfonic acid;hydrateSMILES: CC1=CC=C(C=C1)S(=O)(=O)O.CN1CCC2=C(C1)SC(=N2)C(=O)NC3CC(CCC3NC(=O)C(=O)NC4=NC=C(C=C4)Cl)C(=O)N(C)C.OInChIKey: PSMMNJNZVZZNOI-SJILXJHISA-NInChI: See more
