1-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(5-nitro-2-oxo-indol-3-yl)amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(5-nitro-2-oxo-3-indolyl)amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(5-nitro-2-oxoindol-3-yl)amino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(2-keto-5-nitro-indol-3-yl)amino]-3-(4-nitrophenyl)thiourea Formula: C15H10N6O5S MolecularWeight: 386.3421

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10N6O5S/c22-14-13(11-7-10(21(25)26)5-6-12(11)17-14)18-19-15(27)16-8-1-3-9(4-2-8)20(23)24/h1-7H,(H2,16,19,27)(H,17,18,22)