2-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-1-(4-fluorophenyl)pyrrole-3-carbonitrile

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-1-(4-fluorophenyl)pyrrole-3-carbonitrile Openeye Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-1-(4-fluorophenyl)pyrrole-3-carbonitrile CAS Name: 2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-1-(4-fluorophenyl)-3-pyrrolecarbonitrile IUPAC Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-1-(4-fluorophenyl)pyrrole-3-carbonitrile Traditional Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-1-(4-fluorophenyl)pyrrole-3-carbonitrile Formula: C29H25FN4O MolecularWeight: 464.533403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=C(C=CN4C5=CC=C(C=C5)F)C#N

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=C(C=CN4C5=CC=C(C=C5)F)C#N

InChI

InChI=1S/C29H25FN4O/c30-25-11-13-26(14-12-25)34-16-15-24(21-31)28(34)29(35)33-19-17-32(18-20-33)27(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-16,27H,17-20H2