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

Systemtic Name: 1-[[1-(6-nitro-3-oxidanylidene-quinoxalin-2-ylidene)-2-oxidanyl-2-phenyl-ethyl]amino]thiourea Openeye Name: [[2-hydroxy-1-(6-nitro-3-oxo-quinoxalin-2-ylidene)-2-phenyl-ethyl]amino]thiourea CAS Name: [[2-hydroxy-1-(6-nitro-3-oxo-2-quinoxalinylidene)-2-phenylethyl]amino]thiourea IUPAC Name: [[2-hydroxy-1-(6-nitro-3-oxoquinoxalin-2-ylidene)-2-phenylethyl]amino]thiourea Traditional Name: [[2-hydroxy-1-(3-keto-6-nitro-quinoxalin-2-ylidene)-2-phenyl-ethyl]amino]thiourea Formula: C17H14N6O4S MolecularWeight: 398.39586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N6O4S/c18-17(28)22-21-13(15(24)9-4-2-1-3-5-9)14-16(25)20-12-8-10(23(26)27)6-7-11(12)19-14/h1-8,15,21,24H,(H3,18,22,28)