(2R)-N-(3-chlorophenyl)-2-[[5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-(3-chlorophenyl)-2-[[5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-N-(3-chlorophenyl)-2-[[5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-(3-chlorophenyl)-2-[[5-(6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydro-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-(3-chlorophenyl)-2-[[5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-N-(3-chlorophenyl)-2-[[5-(6-ketocyclohexa-2,4-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]thio]propionamide Formula: C17H15ClN4O2S MolecularWeight: 374.8446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)Cl)SC2=NC(=C3C=CC=CC3=O)NN2

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=CC=C1)Cl)SC2=NC(=C3C=CC=CC3=O)NN2

InChI

InChI=1S/C17H15ClN4O2S/c1-10(16(24)19-12-6-4-5-11(18)9-12)25-17-20-15(21-22-17)13-7-2-3-8-14(13)23/h2-10,21H,1H3,(H,19,24)(H,20,22)/t10-/m1/s1