[5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methylpiperidin-1-yl)methanone

Systemtic Name: [5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methylpiperidin-1-yl)methanone Openeye Name: [5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methyl-1-piperidyl)methanone CAS Name: [5-(1-azepanylsulfonyl)-2-methylphenyl]-(4-methyl-1-piperidinyl)methanone IUPAC Name: [5-(azepan-1-ylsulfonyl)-2-methylphenyl]-(4-methylpiperidin-1-yl)methanone Traditional Name: [5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methylpiperidino)methanone Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C20H30N2O3S/c1-16-9-13-21(14-10-16)20(23)19-15-18(8-7-17(19)2)26(24,25)22-11-5-3-4-6-12-22/h7-8,15-16H,3-6,9-14H2,1-2H3