5-chloranyl-2-[(3-methoxyphenyl)amino]-N-(3-phenylpropyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-[(3-methoxyphenyl)amino]-N-(3-phenylpropyl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-(3-methoxyanilino)-N-(3-phenylpropyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(3-methoxyanilino)-N-(3-phenylpropyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-(3-methoxyanilino)-N-(3-phenylpropyl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(m-anisidino)-N-(3-phenylpropyl)pyrimidine-4-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=C(C(=N2)C(=O)NCCCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=C(C(=N2)C(=O)NCCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN4O2/c1-28-17-11-5-10-16(13-17)25-21-24-14-18(22)19(26-21)20(27)23-12-6-9-15-7-3-2-4-8-15/h2-5,7-8,10-11,13-14H,6,9,12H2,1H3,(H,23,27)(H,24,25,26)