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

Systemtic Name: N-[3-acetamido-4-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]ethanamide Openeye Name: N-[3-acetamido-4-[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]acetamide CAS Name: N-[3-acetamido-4-[1-oxo-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]phenyl]acetamide IUPAC Name: N-[3-acetamido-4-[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]acetamide Traditional Name: N-[3-acetamido-4-[2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]acetamide Formula: C17H21N5O4S MolecularWeight: 391.44474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O4S/c1-4-7-22-16(26)20-21-17(22)27-9-15(25)13-6-5-12(18-10(2)23)8-14(13)19-11(3)24/h5-6,8H,4,7,9H2,1-3H3,(H,18,23)(H,19,24)(H,20,26)