7-(4-methylphenyl)-5-phenyl-4-[4-(phenylmethyl)piperidin-1-yl]pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-(4-methylphenyl)-5-phenyl-4-[4-(phenylmethyl)piperidin-1-yl]pyrrolo[2,3-d]pyrimidine Openeye Name: 4-(4-benzyl-1-piperidyl)-5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidine CAS Name: 7-(4-methylphenyl)-5-phenyl-4-[4-(phenylmethyl)-1-piperidinyl]pyrrolo[2,3-d]pyrimidine IUPAC Name: 4-(4-benzylpiperidin-1-yl)-7-(4-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 4-(4-benzylpiperidino)-5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidine Formula: C31H30N4 MolecularWeight: 458.5967

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCC(CC4)CC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCC(CC4)CC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H30N4/c1-23-12-14-27(15-13-23)35-21-28(26-10-6-3-7-11-26)29-30(32-22-33-31(29)35)34-18-16-25(17-19-34)20-24-8-4-2-5-9-24/h2-15,21-22,25H,16-20H2,1H3