[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(6-methylpyridin-2-yl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(6-methylpyridin-2-yl)methanone Openeye Name: (6-methyl-2-pyridyl)-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(6-methyl-2-pyridinyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(6-methylpyridin-2-yl)methanone Traditional Name: (6-methyl-2-pyridyl)-(4-tosyl-1,4-diazepan-1-yl)methanone Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=NC(=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=NC(=CC=C3)C

InChI

InChI=1S/C19H23N3O3S/c1-15-7-9-17(10-8-15)26(24,25)22-12-4-11-21(13-14-22)19(23)18-6-3-5-16(2)20-18/h3,5-10H,4,11-14H2,1-2H3