1-(2-bromophenyl)-3-cyano-N-[5-(diethylamino)pentan-2-yl]pyrrole-2-carboxamide

Systemtic Name: 1-(2-bromophenyl)-3-cyano-N-[5-(diethylamino)pentan-2-yl]pyrrole-2-carboxamide Openeye Name: 1-(2-bromophenyl)-3-cyano-N-[4-(diethylamino)-1-methyl-butyl]pyrrole-2-carboxamide CAS Name: 1-(2-bromophenyl)-3-cyano-N-[5-(diethylamino)pentan-2-yl]-2-pyrrolecarboxamide IUPAC Name: 1-(2-bromophenyl)-3-cyano-N-[5-(diethylamino)pentan-2-yl]pyrrole-2-carboxamide Traditional Name: 1-(2-bromophenyl)-3-cyano-N-[4-(diethylamino)-1-methyl-butyl]pyrrole-2-carboxamide Formula: C21H27BrN4O MolecularWeight: 431.36928

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)C1=C(C=CN1C2=CC=CC=C2Br)C#N

Isomeric SMILES

CCN(CC)CCCC(C)NC(=O)C1=C(C=CN1C2=CC=CC=C2Br)C#N

InChI

InChI=1S/C21H27BrN4O/c1-4-25(5-2)13-8-9-16(3)24-21(27)20-17(15-23)12-14-26(20)19-11-7-6-10-18(19)22/h6-7,10-12,14,16H,4-5,8-9,13H2,1-3H3,(H,24,27)