1-(3-bromophenyl)-3-cyano-N-(3,3-diphenylpropyl)pyrrole-2-carboxamide

Systemtic Name: 1-(3-bromophenyl)-3-cyano-N-(3,3-diphenylpropyl)pyrrole-2-carboxamide Openeye Name: 1-(3-bromophenyl)-3-cyano-N-(3,3-diphenylpropyl)pyrrole-2-carboxamide CAS Name: 1-(3-bromophenyl)-3-cyano-N-(3,3-diphenylpropyl)-2-pyrrolecarboxamide IUPAC Name: 1-(3-bromophenyl)-3-cyano-N-(3,3-diphenylpropyl)pyrrole-2-carboxamide Traditional Name: 1-(3-bromophenyl)-3-cyano-N-(3,3-diphenylpropyl)pyrrole-2-carboxamide Formula: C27H22BrN3O MolecularWeight: 484.38708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC(=O)C2=C(C=CN2C3=CC(=CC=C3)Br)C#N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC(=O)C2=C(C=CN2C3=CC(=CC=C3)Br)C#N)C4=CC=CC=C4

InChI

InChI=1S/C27H22BrN3O/c28-23-12-7-13-24(18-23)31-17-15-22(19-29)26(31)27(32)30-16-14-25(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-13,15,17-18,25H,14,16H2,(H,30,32)