1-(2-bromophenyl)-3-cyano-N-[1-(phenylmethyl)piperidin-4-yl]pyrrole-2-carboxamide

Systemtic Name: 1-(2-bromophenyl)-3-cyano-N-[1-(phenylmethyl)piperidin-4-yl]pyrrole-2-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-1-(2-bromophenyl)-3-cyano-pyrrole-2-carboxamide CAS Name: 1-(2-bromophenyl)-3-cyano-N-[1-(phenylmethyl)-4-piperidinyl]-2-pyrrolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-1-(2-bromophenyl)-3-cyanopyrrole-2-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-1-(2-bromophenyl)-3-cyano-pyrrole-2-carboxamide Formula: C24H23BrN4O MolecularWeight: 463.36962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=C(C=CN2C3=CC=CC=C3Br)C#N)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=C(C=CN2C3=CC=CC=C3Br)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C24H23BrN4O/c25-21-8-4-5-9-22(21)29-15-10-19(16-26)23(29)24(30)27-20-11-13-28(14-12-20)17-18-6-2-1-3-7-18/h1-10,15,20H,11-14,17H2,(H,27,30)