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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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