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

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-[(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-p-anisyl-thiourea Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NNC=C2C=CC(=O)C(=C2)O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NNC=C2C=CC(=O)C(=C2)O

InChI

InChI=1S/C16H17N3O3S/c1-22-13-5-2-11(3-6-13)9-17-16(23)19-18-10-12-4-7-14(20)15(21)8-12/h2-8,10,18,21H,9H2,1H3,(H2,17,19,23)