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

Systemtic Name: 1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Openeye Name: 1-[(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea CAS Name: 1-[(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Traditional Name: 1-[(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-nitrophenyl)thiourea Formula: C14H11ClN4O3S MolecularWeight: 350.78014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN4O3S/c15-10-5-6-13(20)9(7-10)8-16-18-14(23)17-11-3-1-2-4-12(11)19(21)22/h1-8,16H,(H2,17,18,23)