1-[(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[(3-chloro-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[(3-chloro-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[(3-chloro-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[(3-chloro-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methoxyphenyl)thiourea Formula: C15H13ClN4O4S MolecularWeight: 380.80612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NNC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13ClN4O4S/c1-24-12-4-2-11(3-5-12)18-15(25)19-17-8-9-6-10(16)7-13(14(9)21)20(22)23/h2-8,17H,1H3,(H2,18,19,25)