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

Systemtic Name: 2-methyl-N-[4-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]propanamide Openeye Name: 2-methyl-N-[4-[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]propanamide CAS Name: 2-methyl-N-[4-[1-oxo-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]-2-methyl-propionamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)C(C)C

InChI

InChI=1S/C17H22N4O3S/c1-4-9-21-16(24)19-20-17(21)25-10-14(22)12-5-7-13(8-6-12)18-15(23)11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,18,23)(H,19,24)