2-(4-methylsulfonyl-1,4-diazepan-1-yl)-3-nitro-imidazo[1,2-a]pyridine

Systemtic Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-3-nitro-imidazo[1,2-a]pyridine Openeye Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-3-nitro-imidazo[1,2-a]pyridine CAS Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-3-nitroimidazo[1,2-a]pyridine IUPAC Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-3-nitroimidazo[1,2-a]pyridine Traditional Name: 2-(4-mesyl-1,4-diazepan-1-yl)-3-nitro-imidazo[1,2-a]pyridine Formula: C13H17N5O4S MolecularWeight: 339.37018

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C2=C(N3C=CC=CC3=N2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C2=C(N3C=CC=CC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N5O4S/c1-23(21,22)16-7-4-6-15(9-10-16)12-13(18(19)20)17-8-3-2-5-11(17)14-12/h2-3,5,8H,4,6-7,9-10H2,1H3