1-(2-nitrophenyl)-3-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-(2-nitrophenyl)-3-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-(2-nitrophenyl)-3-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: 1-(2-nitrophenyl)-3-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]thiourea IUPAC Name: 1-(2-nitrophenyl)-3-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Formula: C14H12N4O3S MolecularWeight: 316.33508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=S)NNC=C2C=CC=CC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC(=S)NNC=C2C=CC=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O3S/c19-13-8-4-1-5-10(13)9-15-17-14(22)16-11-6-2-3-7-12(11)18(20)21/h1-9,15H,(H2,16,17,22)