3,4-bis[(4-methylphenyl)amino]-1-(phenylcarbonyl)pyrrole-2,5-dicarbonitrile

Systemtic Name: 3,4-bis[(4-methylphenyl)amino]-1-(phenylcarbonyl)pyrrole-2,5-dicarbonitrile Openeye Name: 1-benzoyl-3,4-bis(4-methylanilino)pyrrole-2,5-dicarbonitrile CAS Name: 1-benzoyl-3,4-bis(4-methylanilino)pyrrole-2,5-dicarbonitrile IUPAC Name: 1-benzoyl-3,4-bis(4-methylanilino)pyrrole-2,5-dicarbonitrile Traditional Name: 1-benzoyl-3,4-bis(p-toluidino)pyrrole-2,5-dicarbonitrile Formula: C27H21N5O MolecularWeight: 431.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(N(C(=C2NC3=CC=C(C=C3)C)C#N)C(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(N(C(=C2NC3=CC=C(C=C3)C)C#N)C(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C27H21N5O/c1-18-8-12-21(13-9-18)30-25-23(16-28)32(27(33)20-6-4-3-5-7-20)24(17-29)26(25)31-22-14-10-19(2)11-15-22/h3-15,30-31H,1-2H3