4-(5-methylthiophen-2-yl)-4-oxidanylidene-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: 4-(5-methylthiophen-2-yl)-4-oxidanylidene-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]butanamide Openeye Name: 4-(5-methyl-2-thienyl)-4-oxo-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]butanamide CAS Name: 4-(5-methyl-2-thiophenyl)-4-oxo-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]butanamide IUPAC Name: 4-(5-methylthiophen-2-yl)-4-oxo-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]butanamide Traditional Name: 4-keto-4-(5-methyl-2-thienyl)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]butyramide Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C19H20N4O2S/c1-14-2-8-18(26-14)17(24)7-9-19(25)21-10-15-3-5-16(6-4-15)11-23-13-20-12-22-23/h2-6,8,12-13H,7,9-11H2,1H3,(H,21,25)