1-[(Z)-3-oxidanylidene-3-phenyl-1-phenylazanyl-2-(1,2,4-triazol-1-yl)prop-1-enyl]sulfanylbutan-2-one

Systemtic Name: 1-[(Z)-3-oxidanylidene-3-phenyl-1-phenylazanyl-2-(1,2,4-triazol-1-yl)prop-1-enyl]sulfanylbutan-2-one Openeye Name: 1-[(Z)-1-anilino-3-oxo-3-phenyl-2-(1,2,4-triazol-1-yl)prop-1-enyl]sulfanylbutan-2-one CAS Name: 1-[[(Z)-1-anilino-3-oxo-3-phenyl-2-(1,2,4-triazol-1-yl)prop-1-enyl]thio]-2-butanone IUPAC Name: 1-[(Z)-1-anilino-3-oxo-3-phenyl-2-(1,2,4-triazol-1-yl)prop-1-enyl]sulfanylbutan-2-one Traditional Name: 1-[[(Z)-1-anilino-3-keto-3-phenyl-2-(1,2,4-triazol-1-yl)prop-1-enyl]thio]butan-2-one Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CSC(=C(C(=O)C1=CC=CC=C1)N2C=NC=N2)NC3=CC=CC=C3

Isomeric SMILES

CCC(=O)CS/C(=C(/C(=O)C1=CC=CC=C1)\N2C=NC=N2)/NC3=CC=CC=C3

InChI

InChI=1S/C21H20N4O2S/c1-2-18(26)13-28-21(24-17-11-7-4-8-12-17)19(25-15-22-14-23-25)20(27)16-9-5-3-6-10-16/h3-12,14-15,24H,2,13H2,1H3/b21-19-