4-[(3,4-dimethoxyphenyl)amino]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 4-[(3,4-dimethoxyphenyl)amino]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-phenyl-pyrimidine-5-carboxamide Openeye Name: 4-(3,4-dimethoxyanilino)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-phenyl-pyrimidine-5-carboxamide CAS Name: 4-(3,4-dimethoxyanilino)-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: 4-(3,4-dimethoxyanilino)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-phenylpyrimidine-5-carboxamide Traditional Name: 4-(3,4-dimethoxyanilino)-N-[3-(2-ketopyrrolidino)propyl]-2-phenyl-pyrimidine-5-carboxamide Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC=C2C(=O)NCCCN3CCCC3=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC=C2C(=O)NCCCN3CCCC3=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H29N5O4/c1-34-21-12-11-19(16-22(21)35-2)29-25-20(17-28-24(30-25)18-8-4-3-5-9-18)26(33)27-13-7-15-31-14-6-10-23(31)32/h3-5,8-9,11-12,16-17H,6-7,10,13-15H2,1-2H3,(H,27,33)(H,28,29,30)