(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: (1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)methanone CAS Name: [1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(1-methyl-4-pyrrolidin-1-ylsulfonylpyrrol-2-yl)methanone Traditional Name: (4-benzylpiperidino)-(1-methyl-4-pyrrolidinosulfonyl-pyrrol-2-yl)methanone Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCC(CC2)CC3=CC=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCC(CC2)CC3=CC=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H29N3O3S/c1-23-17-20(29(27,28)25-11-5-6-12-25)16-21(23)22(26)24-13-9-19(10-14-24)15-18-7-3-2-4-8-18/h2-4,7-8,16-17,19H,5-6,9-15H2,1H3