4-[ethyl-(3-methylphenyl)amino]-2-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrimidine-5-carboxamide

Systemtic Name: 4-[ethyl-(3-methylphenyl)amino]-2-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrimidine-5-carboxamide Openeye Name: 4-(N-ethyl-3-methyl-anilino)-2-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrimidine-5-carboxamide CAS Name: 4-(N-ethyl-3-methylanilino)-2-phenyl-N-[2-(1-pyrrolidinyl)ethyl]-5-pyrimidinecarboxamide IUPAC Name: 4-(N-ethyl-3-methylanilino)-2-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrimidine-5-carboxamide Traditional Name: 4-(N-ethyl-3-methyl-anilino)-2-phenyl-N-(2-pyrrolidinoethyl)pyrimidine-5-carboxamide Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC(=NC=C2C(=O)NCCN3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC(=NC=C2C(=O)NCCN3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N5O/c1-3-31(22-13-9-10-20(2)18-22)25-23(26(32)27-14-17-30-15-7-8-16-30)19-28-24(29-25)21-11-5-4-6-12-21/h4-6,9-13,18-19H,3,7-8,14-17H2,1-2H3,(H,27,32)