4-(2-chlorophenyl)-N-cyclopentyl-N-(3-methoxyphenyl)-2-piperidin-1-yl-pyrimidine-5-carboxamide

Systemtic Name: 4-(2-chlorophenyl)-N-cyclopentyl-N-(3-methoxyphenyl)-2-piperidin-1-yl-pyrimidine-5-carboxamide Openeye Name: 4-(2-chlorophenyl)-N-cyclopentyl-N-(3-methoxyphenyl)-2-(1-piperidyl)pyrimidine-5-carboxamide CAS Name: 4-(2-chlorophenyl)-N-cyclopentyl-N-(3-methoxyphenyl)-2-(1-piperidinyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(2-chlorophenyl)-N-cyclopentyl-N-(3-methoxyphenyl)-2-piperidin-1-ylpyrimidine-5-carboxamide Traditional Name: 4-(2-chlorophenyl)-N-cyclopentyl-N-(3-methoxyphenyl)-2-piperidino-pyrimidine-5-carboxamide Formula: C28H31ClN4O2 MolecularWeight: 491.02434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(C2CCCC2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4Cl)N5CCCCC5

Isomeric SMILES

COC1=CC=CC(=C1)N(C2CCCC2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4Cl)N5CCCCC5

InChI

InChI=1S/C28H31ClN4O2/c1-35-22-13-9-12-21(18-22)33(20-10-3-4-11-20)27(34)24-19-30-28(32-16-7-2-8-17-32)31-26(24)23-14-5-6-15-25(23)29/h5-6,9,12-15,18-20H,2-4,7-8,10-11,16-17H2,1H3