methyl 3-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazole-5-carboxylate

Systemtic Name: methyl 3-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazole-5-carboxylate Openeye Name: methyl 3-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazole-5-carboxylate CAS Name: 3-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazole-5-carboxylate Traditional Name: 3-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazole-5-carboxylic acid methyl ester Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=C(C=C4)C(=O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=C(C=C4)C(=O)OC

InChI

InChI=1S/C21H19N5O2/c1-14(15-6-4-3-5-7-15)24-21-22-11-10-19(25-21)26-13-23-17-9-8-16(12-18(17)26)20(27)28-2/h3-14H,1-2H3,(H,22,24,25)