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DifenidolIUPAC Name: 1,1-diphenyl-4-(piperidin-1-yl)butan-1-olSMILES: OC(c1ccccc1)(c1ccccc1)CCCN1CCCCC1InChIKey: OGAKLTJNUQRZJU-UHFFFAOYSA-NInChI: 1S/C21H27NO/c23-21(19-11-4-1-5-12-19,20-13-6-2-7-14-20)15-10-18-22-16-8-3-9-17-22/h1-2,4-7,11-14,23H,3,8-10,15-18H2
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DL-4-氯苯丙氨酸CAS号: 7424-00-2分子式: C9H10ClNO2 分子量: 199.63IUPAC Name: 2-amino-3-(4-chlorophenyl)propanoic acidSMILES: C1=CC(=CC=C1CC(C(=O)O)N)ClInChIKey: NIGWMJHCCYYCSF-UHFFFAOYSA-NInChI: 1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)
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α-甲基-DL-苯丙氨酸CAS号: 1132-26-9分子式: C10H13NO2 分子量: 179.22IUPAC Name: 2-amino-2-methyl-3-phenylpropanoic acidSMILES: CC(CC1=CC=CC=C1)(C(=O)O)NInChIKey: HYOWVAAEQCNGLE-UHFFFAOYSA-NInChI: 1S/C10H13NO2/c1-10(11,9(12)13)7-8-5-3-2-4-6-8/h2-6H,7,11H2,1H3,(H,12,13)
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FluphenazineCAS号: 69-23-8分子式: C22H26F3N3OS 分子量: 437.53IUPAC Name: 2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethanolSMILES: C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCOInChIKey: PLDUPXSUYLZYBN-UHFFFAOYSA-NInChI: 1S/C22H26F3N3OS/c23-22(24,25)17-6-7-21-19(16-17)28(18-4-1-2-5-20(18)30-21)9-3-8-26-10-12-27(13-11-26)14-15-29/h1-2,4-7,16,29H,3,8-15H2
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特康唑CAS号: 67915-31-5 Compound CID : 441383分子式: C26H31Cl2N5O3 分子量: 532.46IUPAC Name: 1-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-4-propan-2-ylpiperazineSMILES: CC(C)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=NC=N4)C5=C(C=C(C=C5)Cl)ClInChIKey: BLSQLHNBWJLIBQ-OZXSUGGESA-NInChI: 1S/C26H31Cl2N5O3/c1-19(2)31-9-11-32(12-10-31)21-4-6-22(7-5-21)34-14-23-15-35-26(36-23,16-33-18-29-17-30-33)24-8-3-20(27)13-25(24)28/h3-8,13,17-19,23H,9-12,14-16H2,1-2H3/t23-,26-/m0/s1
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DL-4-氯苯丙氨酸CAS号: 7424-00-2分子式: C9H10ClNO2 分子量: 199.63IUPAC Name: 2-amino-3-(4-chlorophenyl)propanoic acidSMILES: C1=CC(=CC=C1CC(C(=O)O)N)ClInChIKey: NIGWMJHCCYYCSF-UHFFFAOYSA-NInChI: 1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)
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TerconazoleCAS号: 67915-31-5 Compound CID : 441383分子式: C26H31Cl2N5O3 分子量: 532.46IUPAC Name: 1-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-4-propan-2-ylpiperazineSMILES: CC(C)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=NC=N4)C5=C(C=C(C=C5)Cl)ClInChIKey: BLSQLHNBWJLIBQ-OZXSUGGESA-NInChI: 1S/C26H31Cl2N5O3/c1-19(2)31-9-11-32(12-10-31)21-4-6-22(7-5-21)34-14-23-15-35-26(36-23,16-33-18-29-17-30-33)24-8-3-20(27)13-25(24)28/h3-8,13,17-19,23H,9-12,14-16H2,1-2H3/t23-,26-/m0/s1
