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

Systemtic Name: 1-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenyl-thiourea Openeye Name: 1-[(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenyl-thiourea CAS Name: 1-[(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-phenylthiourea IUPAC Name: 1-[(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenylthiourea Traditional Name: 1-[(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenyl-thiourea Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNNC(=S)NC2=CC=CC=C2)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=CNNC(=S)NC2=CC=CC=C2)C=C(C1=O)C

InChI

InChI=1S/C16H17N3OS/c1-11-8-13(9-12(2)15(11)20)10-17-19-16(21)18-14-6-4-3-5-7-14/h3-10,17H,1-2H3,(H2,18,19,21)