4-[ethyl-(3-methylphenyl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 4-[ethyl-(3-methylphenyl)amino]-N-methyl-N-(1-methylpiperidin-4-yl)-2-phenyl-pyrimidine-5-carboxamide Openeye Name: 4-(N-ethyl-3-methyl-anilino)-N-methyl-N-(1-methyl-4-piperidyl)-2-phenyl-pyrimidine-5-carboxamide CAS Name: 4-(N-ethyl-3-methylanilino)-N-methyl-N-(1-methyl-4-piperidinyl)-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: 4-(N-ethyl-3-methylanilino)-N-methyl-N-(1-methylpiperidin-4-yl)-2-phenylpyrimidine-5-carboxamide Traditional Name: 4-(N-ethyl-3-methyl-anilino)-N-methyl-N-(1-methyl-4-piperidyl)-2-phenyl-pyrimidine-5-carboxamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC(=NC=C2C(=O)N(C)C3CCN(CC3)C)C4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC(=NC=C2C(=O)N(C)C3CCN(CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C27H33N5O/c1-5-32(23-13-9-10-20(2)18-23)26-24(19-28-25(29-26)21-11-7-6-8-12-21)27(33)31(4)22-14-16-30(3)17-15-22/h6-13,18-19,22H,5,14-17H2,1-4H3