N-[4-(azepan-1-yl)phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=C(C=C3)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C25H33N3O3S/c1-20-9-14-23(32(30,31)28-17-7-4-8-18-28)19-24(20)25(29)26-21-10-12-22(13-11-21)27-15-5-2-3-6-16-27/h9-14,19H,2-8,15-18H2,1H3,(H,26,29)