2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-dimethylaminophenyl)methyl]ethanamide

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-dimethylaminophenyl)methyl]ethanamide Openeye Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-dimethylaminophenyl)methyl]acetamide CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-[(4-dimethylaminophenyl)methyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-dimethylaminophenyl)methyl]acetamide Traditional Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-[4-(dimethylamino)benzyl]acetamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)CSC2=NNC(=N2)C3CC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)CSC2=NNC(=N2)C3CC3

InChI

InChI=1S/C16H21N5OS/c1-21(2)13-7-3-11(4-8-13)9-17-14(22)10-23-16-18-15(19-20-16)12-5-6-12/h3-4,7-8,12H,5-6,9-10H2,1-2H3,(H,17,22)(H,18,19,20)