N-(3,5-dimethylphenyl)-5,6-dimethyl-7-phenyl-4-piperidin-1-yl-pyrrolo[2,3-d]pyrimidine-2-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-5,6-dimethyl-7-phenyl-4-piperidin-1-yl-pyrrolo[2,3-d]pyrimidine-2-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-5,6-dimethyl-7-phenyl-4-(1-piperidyl)pyrrolo[2,3-d]pyrimidine-2-carboxamide CAS Name: N-(3,5-dimethylphenyl)-5,6-dimethyl-7-phenyl-4-(1-piperidinyl)-2-pyrrolo[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-5,6-dimethyl-7-phenyl-4-piperidin-1-ylpyrrolo[2,3-d]pyrimidine-2-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-5,6-dimethyl-7-phenyl-4-piperidino-pyrrolo[2,3-d]pyrimidine-2-carboxamide Formula: C28H31N5O MolecularWeight: 453.57864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=NC3=C(C(=C(N3C4=CC=CC=C4)C)C)C(=N2)N5CCCCC5)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=NC3=C(C(=C(N3C4=CC=CC=C4)C)C)C(=N2)N5CCCCC5)C

InChI

InChI=1S/C28H31N5O/c1-18-15-19(2)17-22(16-18)29-28(34)25-30-26(32-13-9-6-10-14-32)24-20(3)21(4)33(27(24)31-25)23-11-7-5-8-12-23/h5,7-8,11-12,15-17H,6,9-10,13-14H2,1-4H3,(H,29,34)