2-(butan-2-ylamino)-4-[1-(4-chlorophenyl)cyclobutyl]-N,N-diethyl-pyrimidine-5-carboxamide

Systemtic Name: 2-(butan-2-ylamino)-4-[1-(4-chlorophenyl)cyclobutyl]-N,N-diethyl-pyrimidine-5-carboxamide Openeye Name: 4-[1-(4-chlorophenyl)cyclobutyl]-N,N-diethyl-2-(sec-butylamino)pyrimidine-5-carboxamide CAS Name: 2-(butan-2-ylamino)-4-[1-(4-chlorophenyl)cyclobutyl]-N,N-diethyl-5-pyrimidinecarboxamide IUPAC Name: 2-(butan-2-ylamino)-4-[1-(4-chlorophenyl)cyclobutyl]-N,N-diethylpyrimidine-5-carboxamide Traditional Name: 4-[1-(4-chlorophenyl)cyclobutyl]-N,N-diethyl-2-(sec-butylamino)pyrimidine-5-carboxamide Formula: C23H31ClN4O MolecularWeight: 414.97144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=C(C(=N1)C2(CCC2)C3=CC=C(C=C3)Cl)C(=O)N(CC)CC

Isomeric SMILES

CCC(C)NC1=NC=C(C(=N1)C2(CCC2)C3=CC=C(C=C3)Cl)C(=O)N(CC)CC

InChI

InChI=1S/C23H31ClN4O/c1-5-16(4)26-22-25-15-19(21(29)28(6-2)7-3)20(27-22)23(13-8-14-23)17-9-11-18(24)12-10-17/h9-12,15-16H,5-8,13-14H2,1-4H3,(H,25,26,27)