1-(4-methylphenyl)-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-[1-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylamino]-3-(p-tolyl)thiourea CAS Name: 1-[1-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[1-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]-3-(4-methylphenyl)thiourea Traditional Name: 1-[1-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)ethylamino]-3-(p-tolyl)thiourea Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC(=C2C=CC(=O)C=C2O)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC(=C2C=CC(=O)C=C2O)C

InChI

InChI=1S/C16H17N3O2S/c1-10-3-5-12(6-4-10)17-16(22)19-18-11(2)14-8-7-13(20)9-15(14)21/h3-9,18,21H,1-2H3,(H2,17,19,22)