1-(2-bromophenyl)-3-cyano-N-[3-(2-methylpiperidin-1-yl)propyl]pyrrole-2-carboxamide

Systemtic Name: 1-(2-bromophenyl)-3-cyano-N-[3-(2-methylpiperidin-1-yl)propyl]pyrrole-2-carboxamide Openeye Name: 1-(2-bromophenyl)-3-cyano-N-[3-(2-methyl-1-piperidyl)propyl]pyrrole-2-carboxamide CAS Name: 1-(2-bromophenyl)-3-cyano-N-[3-(2-methyl-1-piperidinyl)propyl]-2-pyrrolecarboxamide IUPAC Name: 1-(2-bromophenyl)-3-cyano-N-[3-(2-methylpiperidin-1-yl)propyl]pyrrole-2-carboxamide Traditional Name: 1-(2-bromophenyl)-3-cyano-N-[3-(2-methylpiperidino)propyl]pyrrole-2-carboxamide Formula: C21H25BrN4O MolecularWeight: 429.3534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=C(C=CN2C3=CC=CC=C3Br)C#N

Isomeric SMILES

CC1CCCCN1CCCNC(=O)C2=C(C=CN2C3=CC=CC=C3Br)C#N

InChI

InChI=1S/C21H25BrN4O/c1-16-7-4-5-12-25(16)13-6-11-24-21(27)20-17(15-23)10-14-26(20)19-9-3-2-8-18(19)22/h2-3,8-10,14,16H,4-7,11-13H2,1H3,(H,24,27)