1-[(3-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[(3-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methylphenyl)thiourea Openeye Name: 1-[(3-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(p-tolyl)thiourea CAS Name: 1-[(3-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[(3-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methylphenyl)thiourea Traditional Name: 1-[(6-keto-3-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-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=C(C=CC2=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC=C2C=C(C=CC2=O)OC

InChI

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