ethyl 4-(benzimidazol-1-yl)-2-(1-phenylethylamino)pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(benzimidazol-1-yl)-2-(1-phenylethylamino)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(benzimidazol-1-yl)-2-(1-phenylethylamino)pyrimidine-5-carboxylate CAS Name: 4-(1-benzimidazolyl)-2-(1-phenylethylamino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzimidazol-1-yl)-2-(1-phenylethylamino)pyrimidine-5-carboxylate Traditional Name: 4-(benzimidazol-1-yl)-2-(1-phenylethylamino)pyrimidine-5-carboxylic acid ethyl ester Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N2C=NC3=CC=CC=C32)NC(C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N2C=NC3=CC=CC=C32)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2/c1-3-29-21(28)17-13-23-22(25-15(2)16-9-5-4-6-10-16)26-20(17)27-14-24-18-11-7-8-12-19(18)27/h4-15H,3H2,1-2H3,(H,23,25,26)