N-[(4-methoxyphenyl)methyl]-2-[(4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-[(4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[[4-(1-pyrrolyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-[(4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-p-anisyl-2-[(4-pyrrol-1-yl-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H17N5O2S MolecularWeight: 343.40348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CSC2=NN=CN2N3C=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CSC2=NN=CN2N3C=CC=C3

InChI

InChI=1S/C16H17N5O2S/c1-23-14-6-4-13(5-7-14)10-17-15(22)11-24-16-19-18-12-21(16)20-8-2-3-9-20/h2-9,12H,10-11H2,1H3,(H,17,22)