N'-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-4-[(phenylmethylsulfanyl)methyl]benzohydrazide

Systemtic Name: N'-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-4-[(phenylmethylsulfanyl)methyl]benzohydrazide Openeye Name: 4-(benzylsulfanylmethyl)-N'-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]benzohydrazide CAS Name: N'-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-[(phenylmethylthio)methyl]benzohydrazide IUPAC Name: 4-(benzylsulfanylmethyl)-N'-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzohydrazide Traditional Name: 4-[(benzylthio)methyl]-N'-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]benzohydrazide Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=CC=C(C=C2)CSCC3=CC=CC=C3)C=CC1=O

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=CC=C(C=C2)CSCC3=CC=CC=C3)C=CC1=O

InChI

InChI=1S/C23H22N2O3S/c1-28-22-13-19(9-12-21(22)26)14-24-25-23(27)20-10-7-18(8-11-20)16-29-15-17-5-3-2-4-6-17/h2-14,24H,15-16H2,1H3,(H,25,27)