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

Systemtic Name: 1-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Openeye Name: 1-[(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea CAS Name: 1-[(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Traditional Name: 1-[(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNNC(=S)NC2=CC=CC=C2[N+](=O)[O-])C=C(C1=O)C

Isomeric SMILES

CC1=CC(=CNNC(=S)NC2=CC=CC=C2[N+](=O)[O-])C=C(C1=O)C

InChI

InChI=1S/C16H16N4O3S/c1-10-7-12(8-11(2)15(10)21)9-17-19-16(24)18-13-5-3-4-6-14(13)20(22)23/h3-9,17H,1-2H3,(H2,18,19,24)