[2-[2-dimethylaminoethyl(methyl)amino]-5-methylsulfonyl-4-(4-phenylpiperidin-1-yl)phenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-[2-dimethylaminoethyl(methyl)amino]-5-methylsulfonyl-4-(4-phenylpiperidin-1-yl)phenyl]-piperidin-1-yl-methanone Openeye Name: [2-[2-dimethylaminoethyl(methyl)amino]-5-methylsulfonyl-4-(4-phenyl-1-piperidyl)phenyl]-(1-piperidyl)methanone CAS Name: [2-[2-dimethylaminoethyl(methyl)amino]-5-methylsulfonyl-4-(4-phenyl-1-piperidinyl)phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-[2-dimethylaminoethyl(methyl)amino]-5-methylsulfonyl-4-(4-phenylpiperidin-1-yl)phenyl]-piperidin-1-ylmethanone Traditional Name: [2-[2-dimethylaminoethyl(methyl)amino]-5-mesyl-4-(4-phenylpiperidino)phenyl]-piperidino-methanone Formula: C29H42N4O3S MolecularWeight: 526.73378

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C)C1=CC(=C(C=C1C(=O)N2CCCCC2)S(=O)(=O)C)N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CN(C)CCN(C)C1=CC(=C(C=C1C(=O)N2CCCCC2)S(=O)(=O)C)N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C29H42N4O3S/c1-30(2)19-20-31(3)26-22-27(32-17-13-24(14-18-32)23-11-7-5-8-12-23)28(37(4,35)36)21-25(26)29(34)33-15-9-6-10-16-33/h5,7-8,11-12,21-22,24H,6,9-10,13-20H2,1-4H3