[1-(4-bromophenyl)carbonylpiperidin-4-yl]-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone

Systemtic Name: [1-(4-bromophenyl)carbonylpiperidin-4-yl]-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone Openeye Name: [1-(4-bromobenzoyl)-4-piperidyl]-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone CAS Name: [1-[(4-bromophenyl)-oxomethyl]-4-piperidinyl]-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone IUPAC Name: [1-(4-bromobenzoyl)piperidin-4-yl]-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone Traditional Name: [1-(4-bromobenzoyl)-4-piperidyl]-(4-mesyl-1,4-diazepan-1-yl)methanone Formula: C19H26BrN3O4S MolecularWeight: 472.39644

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H26BrN3O4S/c1-28(26,27)23-10-2-9-21(13-14-23)19(25)16-7-11-22(12-8-16)18(24)15-3-5-17(20)6-4-15/h3-6,16H,2,7-14H2,1H3