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

Systemtic Name: azepan-1-yl-[1-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(2-methyl-5-pyrrolidin-1-ylsulfonylbenzoyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(2-methyl-5-pyrrolidinosulfonyl-benzoyl)-4-piperidyl]methanone Formula: C24H35N3O4S MolecularWeight: 461.6174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C24H35N3O4S/c1-19-8-9-21(32(30,31)27-14-6-7-15-27)18-22(19)24(29)26-16-10-20(11-17-26)23(28)25-12-4-2-3-5-13-25/h8-9,18,20H,2-7,10-17H2,1H3