1-[[2-(3,4-dimethoxyphenyl)-1-(6-nitro-3-oxidanylidene-quinoxalin-2-ylidene)-2-oxidanyl-ethyl]amino]thiourea

Systemtic Name: 1-[[2-(3,4-dimethoxyphenyl)-1-(6-nitro-3-oxidanylidene-quinoxalin-2-ylidene)-2-oxidanyl-ethyl]amino]thiourea Openeye Name: [[2-(3,4-dimethoxyphenyl)-2-hydroxy-1-(6-nitro-3-oxo-quinoxalin-2-ylidene)ethyl]amino]thiourea CAS Name: [[2-(3,4-dimethoxyphenyl)-2-hydroxy-1-(6-nitro-3-oxo-2-quinoxalinylidene)ethyl]amino]thiourea IUPAC Name: [[2-(3,4-dimethoxyphenyl)-2-hydroxy-1-(6-nitro-3-oxoquinoxalin-2-ylidene)ethyl]amino]thiourea Traditional Name: [[2-(3,4-dimethoxyphenyl)-2-hydroxy-1-(3-keto-6-nitro-quinoxalin-2-ylidene)ethyl]amino]thiourea Formula: C19H18N6O6S MolecularWeight: 458.44782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=C2C(=O)N=C3C=C(C=CC3=N2)[N+](=O)[O-])NNC(=S)N)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=C2C(=O)N=C3C=C(C=CC3=N2)[N+](=O)[O-])NNC(=S)N)O)OC

InChI

InChI=1S/C19H18N6O6S/c1-30-13-6-3-9(7-14(13)31-2)17(26)15(23-24-19(20)32)16-18(27)22-12-8-10(25(28)29)4-5-11(12)21-16/h3-8,17,23,26H,1-2H3,(H3,20,24,32)