1-azanyl-3-[[1-(6-chloranyl-3-oxidanylidene-quinoxalin-2-ylidene)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]thiourea

Systemtic Name: 1-azanyl-3-[[1-(6-chloranyl-3-oxidanylidene-quinoxalin-2-ylidene)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]thiourea Openeye Name: 1-amino-3-[[1-(6-chloro-3-oxo-quinoxalin-2-ylidene)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]thiourea CAS Name: 1-amino-3-[[1-(6-chloro-3-oxo-2-quinoxalinylidene)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]thiourea IUPAC Name: 1-amino-3-[[1-(6-chloro-3-oxoquinoxalin-2-ylidene)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]thiourea Traditional Name: 1-amino-3-[[1-(6-chloro-3-keto-quinoxalin-2-ylidene)-2-hydroxy-2-(4-nitrophenyl)ethyl]amino]thiourea Formula: C17H14ClN7O4S MolecularWeight: 447.85556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(=C2C(=O)N=C3C=C(C=CC3=N2)Cl)NNC(=S)NN)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(C(=C2C(=O)N=C3C=C(C=CC3=N2)Cl)NNC(=S)NN)O)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN7O4S/c18-9-3-6-11-12(7-9)21-16(27)14(20-11)13(23-24-17(30)22-19)15(26)8-1-4-10(5-2-8)25(28)29/h1-7,15,23,26H,19H2,(H2,22,24,30)