N-[6-azanyl-2-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]furan-2-carboxamide

Systemtic Name: N-[6-azanyl-2-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]furan-2-carboxamide Openeye Name: N-[6-amino-2-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide CAS Name: N-[6-amino-2-[[2-(4-nitroanilino)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]-2-furancarboxamide IUPAC Name: N-[6-amino-2-[2-(4-nitroanilino)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(4-nitroanilino)ethyl]thio]-1H-pyrimidin-5-yl]-2-furamide Formula: C17H14N6O6S MolecularWeight: 430.39466

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=C(NC(=NC2=O)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])N

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=C(NC(=NC2=O)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])N

InChI

InChI=1S/C17H14N6O6S/c18-14-13(20-15(25)11-2-1-7-29-11)16(26)22-17(21-14)30-8-12(24)19-9-3-5-10(6-4-9)23(27)28/h1-7H,8H2,(H,19,24)(H,20,25)(H3,18,21,22,26)