4-(azepan-1-ylsulfonyl)-2-nitro-N-[phenyl(pyridin-2-yl)methyl]aniline

Systemtic Name: 4-(azepan-1-ylsulfonyl)-2-nitro-N-[phenyl(pyridin-2-yl)methyl]aniline Openeye Name: 4-(azepan-1-ylsulfonyl)-2-nitro-N-[phenyl(2-pyridyl)methyl]aniline CAS Name: 4-(1-azepanylsulfonyl)-2-nitro-N-[phenyl(2-pyridinyl)methyl]aniline IUPAC Name: 4-(azepan-1-ylsulfonyl)-2-nitro-N-[phenyl(pyridin-2-yl)methyl]aniline Traditional Name: [4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]-[phenyl(2-pyridyl)methyl]amine Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C24H26N4O4S/c29-28(30)23-18-20(33(31,32)27-16-8-1-2-9-17-27)13-14-21(23)26-24(19-10-4-3-5-11-19)22-12-6-7-15-25-22/h3-7,10-15,18,24,26H,1-2,8-9,16-17H2