N-methyl-N-[4-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)oxyphenyl]thiophene-2-sulfonamide

Systemtic Name: N-methyl-N-[4-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)oxyphenyl]thiophene-2-sulfonamide Openeye Name: N-methyl-N-[4-(3-nitro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)oxyphenyl]thiophene-2-sulfonamide CAS Name: N-methyl-N-[4-[(3-nitro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)oxy]phenyl]-2-thiophenesulfonamide IUPAC Name: N-methyl-N-[4-(3-nitro-4-oxopyrido[1,2-a]pyrimidin-2-yl)oxyphenyl]thiophene-2-sulfonamide Traditional Name: N-[4-(4-keto-3-nitro-pyrido[1,2-a]pyrimidin-2-yl)oxyphenyl]-N-methyl-thiophene-2-sulfonamide Formula: C19H14N4O6S2 MolecularWeight: 458.46766

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-])S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-])S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H14N4O6S2/c1-21(31(27,28)16-6-4-12-30-16)13-7-9-14(10-8-13)29-18-17(23(25)26)19(24)22-11-3-2-5-15(22)20-18/h2-12H,1H3