2-[[4-(3-acetamidophenyl)-5-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide

Systemtic Name: 2-[[4-(3-acetamidophenyl)-5-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide Openeye Name: 2-[[4-(3-acetamidophenyl)-5-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide CAS Name: 2-[[4-(3-acetamidophenyl)-5-cyclopropyl-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)-3-methylbutanamide IUPAC Name: 2-[[4-(3-acetamidophenyl)-5-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-3-methylbutanamide Traditional Name: 2-[[4-(3-acetamidophenyl)-5-cyclopropyl-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)-3-methyl-butyramide Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2C3=CC(=CC=C3)NC(=O)C)C4CC4

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2C3=CC(=CC=C3)NC(=O)C)C4CC4

InChI

InChI=1S/C25H29N5O3S/c1-15(2)22(24(32)27-18-10-12-21(33-4)13-11-18)34-25-29-28-23(17-8-9-17)30(25)20-7-5-6-19(14-20)26-16(3)31/h5-7,10-15,17,22H,8-9H2,1-4H3,(H,26,31)(H,27,32)