4-(3-chlorophenyl)-6-methyl-N-(3-phenylpropyl)-2-piperidin-1-yl-pyrimidine-5-carboxamide

Systemtic Name: 4-(3-chlorophenyl)-6-methyl-N-(3-phenylpropyl)-2-piperidin-1-yl-pyrimidine-5-carboxamide Openeye Name: 4-(3-chlorophenyl)-6-methyl-N-(3-phenylpropyl)-2-(1-piperidyl)pyrimidine-5-carboxamide CAS Name: 4-(3-chlorophenyl)-6-methyl-N-(3-phenylpropyl)-2-(1-piperidinyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(3-chlorophenyl)-6-methyl-N-(3-phenylpropyl)-2-piperidin-1-ylpyrimidine-5-carboxamide Traditional Name: 4-(3-chlorophenyl)-6-methyl-N-(3-phenylpropyl)-2-piperidino-pyrimidine-5-carboxamide Formula: C26H29ClN4O MolecularWeight: 448.98766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)N4CCCCC4

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)N4CCCCC4

InChI

InChI=1S/C26H29ClN4O/c1-19-23(25(32)28-15-9-12-20-10-4-2-5-11-20)24(21-13-8-14-22(27)18-21)30-26(29-19)31-16-6-3-7-17-31/h2,4-5,8,10-11,13-14,18H,3,6-7,9,12,15-17H2,1H3,(H,28,32)