N-[(4-dimethylaminophenyl)methyl]-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-dimethylaminophenyl)methyl]acetamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-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=NN=CN2CC=C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)CSC2=NN=CN2CC=C

InChI

InChI=1S/C16H21N5OS/c1-4-9-21-12-18-19-16(21)23-11-15(22)17-10-13-5-7-14(8-6-13)20(2)3/h4-8,12H,1,9-11H2,2-3H3,(H,17,22)