2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)propanamide

Systemtic Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)propanamide Openeye Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isobutyl-propanamide CAS Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylpropyl)propanamide IUPAC Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)propanamide Traditional Name: 2-[[4-(3-acetamidophenyl)-1,2,4-triazol-3-yl]thio]-N-isobutyl-propionamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)SC1=NN=CN1C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

CC(C)CNC(=O)C(C)SC1=NN=CN1C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C17H23N5O2S/c1-11(2)9-18-16(24)12(3)25-17-21-19-10-22(17)15-7-5-6-14(8-15)20-13(4)23/h5-8,10-12H,9H2,1-4H3,(H,18,24)(H,20,23)