N,N-diethyl-1-methyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-pyrrole-3-sulfonamide

Systemtic Name: N,N-diethyl-1-methyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-pyrrole-3-sulfonamide Openeye Name: 5-(4-benzylpiperidine-1-carbonyl)-N,N-diethyl-1-methyl-pyrrole-3-sulfonamide CAS Name: N,N-diethyl-1-methyl-5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-3-pyrrolesulfonamide IUPAC Name: 5-(4-benzylpiperidine-1-carbonyl)-N,N-diethyl-1-methylpyrrole-3-sulfonamide Traditional Name: 5-(4-benzylpiperidine-1-carbonyl)-N,N-diethyl-1-methyl-pyrrole-3-sulfonamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H31N3O3S/c1-4-25(5-2)29(27,28)20-16-21(23(3)17-20)22(26)24-13-11-19(12-14-24)15-18-9-7-6-8-10-18/h6-10,16-17,19H,4-5,11-15H2,1-3H3