3,5-dimethyl-1-[(3-methylphenyl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]pyrrole-2-carboxamide

Systemtic Name: 3,5-dimethyl-1-[(3-methylphenyl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]pyrrole-2-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-3,5-dimethyl-1-(m-tolylmethyl)pyrrole-2-carboxamide CAS Name: 3,5-dimethyl-1-[(3-methylphenyl)methyl]-N-[1-(phenylmethyl)-4-piperidinyl]-2-pyrrolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3,5-dimethyl-1-[(3-methylphenyl)methyl]pyrrole-2-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-3,5-dimethyl-1-(3-methylbenzyl)pyrrole-2-carboxamide Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC(=C2C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC(=C2C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C27H33N3O/c1-20-8-7-11-24(16-20)19-30-22(3)17-21(2)26(30)27(31)28-25-12-14-29(15-13-25)18-23-9-5-4-6-10-23/h4-11,16-17,25H,12-15,18-19H2,1-3H3,(H,28,31)