4-(4-imidazo[1,5-a]pyridin-3-ylsulfanyl-3-nitro-phenyl)sulfonylmorpholine

Systemtic Name: 4-(4-imidazo[1,5-a]pyridin-3-ylsulfanyl-3-nitro-phenyl)sulfonylmorpholine Openeye Name: 4-(4-imidazo[1,5-a]pyridin-3-ylsulfanyl-3-nitro-phenyl)sulfonylmorpholine CAS Name: 4-[4-(3-imidazo[1,5-a]pyridinylthio)-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-(4-imidazo[1,5-a]pyridin-3-ylsulfanyl-3-nitrophenyl)sulfonylmorpholine Traditional Name: 4-[4-(imidazo[1,5-a]pyridin-3-ylthio)-3-nitro-phenyl]sulfonylmorpholine Formula: C17H16N4O5S2 MolecularWeight: 420.46274

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SC3=NC=C4N3C=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SC3=NC=C4N3C=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S2/c22-21(23)15-11-14(28(24,25)19-7-9-26-10-8-19)4-5-16(15)27-17-18-12-13-3-1-2-6-20(13)17/h1-6,11-12H,7-10H2