4-[[(4-methylphenyl)methylamino]-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(4-methylphenyl)methylamino]-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(p-tolylmethylamino)-sulfanyl-methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[mercapto-[(4-methylphenyl)methylamino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(4-methylphenyl)methylamino]-sulfanylmethylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[mercapto-[(4-methylbenzyl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C15H15NOS MolecularWeight: 257.3507

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=C2C=CC(=O)C=C2)S

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=C2C=CC(=O)C=C2)S

InChI

InChI=1S/C15H15NOS/c1-11-2-4-12(5-3-11)10-16-15(18)13-6-8-14(17)9-7-13/h2-9,16,18H,10H2,1H3