4-[(3-methoxyphenyl)amino]-N-(3-methylbutyl)-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 4-[(3-methoxyphenyl)amino]-N-(3-methylbutyl)-2-phenyl-pyrimidine-5-carboxamide Openeye Name: N-isopentyl-4-(3-methoxyanilino)-2-phenyl-pyrimidine-5-carboxamide CAS Name: 4-(3-methoxyanilino)-N-(3-methylbutyl)-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: 4-(3-methoxyanilino)-N-(3-methylbutyl)-2-phenylpyrimidine-5-carboxamide Traditional Name: N-isoamyl-4-(m-anisidino)-2-phenyl-pyrimidine-5-carboxamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CN=C(N=C1NC2=CC(=CC=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)C1=CN=C(N=C1NC2=CC(=CC=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H26N4O2/c1-16(2)12-13-24-23(28)20-15-25-21(17-8-5-4-6-9-17)27-22(20)26-18-10-7-11-19(14-18)29-3/h4-11,14-16H,12-13H2,1-3H3,(H,24,28)(H,25,26,27)