azepan-1-yl-[1-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-methoxy-3-pyrrolidinosulfonyl-benzoyl)-4-piperidyl]methanone Formula: C24H35N3O5S MolecularWeight: 477.6168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H35N3O5S/c1-32-21-9-8-20(18-22(21)33(30,31)27-14-6-7-15-27)24(29)26-16-10-19(11-17-26)23(28)25-12-4-2-3-5-13-25/h8-9,18-19H,2-7,10-17H2,1H3