1-[5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)pyrimidin-2-yl]carbonyl-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)pyrimidin-2-yl]carbonyl-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)pyrimidine-2-carbonyl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[[5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-2-pyrimidinyl]-oxomethyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)pyrimidine-2-carbonyl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)pyrimidine-2-carbonyl]-4-phenyl-isonipecotonitrile Formula: C29H21Cl3N4O MolecularWeight: 547.86224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2)C(=O)C3=NC=C(C(=N3)C4=C(C=C(C=C4)Cl)Cl)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2)C(=O)C3=NC=C(C(=N3)C4=C(C=C(C=C4)Cl)Cl)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H21Cl3N4O/c30-21-8-6-19(7-9-21)24-17-34-27(35-26(24)23-11-10-22(31)16-25(23)32)28(37)36-14-12-29(18-33,13-15-36)20-4-2-1-3-5-20/h1-11,16-17H,12-15H2