N-phenyl-N-(4-pyridin-4-yl-1,4-diazepan-1-yl)methanesulfonamide

Systemtic Name: N-phenyl-N-(4-pyridin-4-yl-1,4-diazepan-1-yl)methanesulfonamide Openeye Name: N-phenyl-N-[4-(4-pyridyl)-1,4-diazepan-1-yl]methanesulfonamide CAS Name: N-phenyl-N-(4-pyridin-4-yl-1,4-diazepan-1-yl)methanesulfonamide IUPAC Name: N-phenyl-N-(4-pyridin-4-yl-1,4-diazepan-1-yl)methanesulfonamide Traditional Name: N-phenyl-N-[4-(4-pyridyl)-1,4-diazepan-1-yl]methanesulfonamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1=CC=CC=C1)N2CCCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CS(=O)(=O)N(C1=CC=CC=C1)N2CCCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C17H22N4O2S/c1-24(22,23)21(17-6-3-2-4-7-17)20-13-5-12-19(14-15-20)16-8-10-18-11-9-16/h2-4,6-11H,5,12-15H2,1H3