N-(4-acetamidophenyl)-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-acetamidophenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(4-acetamidophenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-acetamidophenyl)-2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H21N5O3S MolecularWeight: 363.43464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SC(C)C(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCCN1C(=O)NN=C1SC(C)C(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C16H21N5O3S/c1-4-9-21-15(24)19-20-16(21)25-10(2)14(23)18-13-7-5-12(6-8-13)17-11(3)22/h5-8,10H,4,9H2,1-3H3,(H,17,22)(H,18,23)(H,19,24)