2-methoxy-4-[[(phenylmethyl)amino]-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2-methoxy-4-[[(phenylmethyl)amino]-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(benzylamino)-sulfanyl-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[mercapto-[(phenylmethyl)amino]methylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(benzylamino)-sulfanylmethylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[(benzylamino)-mercapto-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C15H15NO2S MolecularWeight: 273.3501

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(NCC2=CC=CC=C2)S)C=CC1=O

Isomeric SMILES

COC1=CC(=C(NCC2=CC=CC=C2)S)C=CC1=O

InChI

InChI=1S/C15H15NO2S/c1-18-14-9-12(7-8-13(14)17)15(19)16-10-11-5-3-2-4-6-11/h2-9,16,19H,10H2,1H3