methyl 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoate

Systemtic Name: methyl 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoate Openeye Name: methyl 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoate CAS Name: 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoate Traditional Name: 4-[6-(1,4,5,6-tetrahydropyrimidin-2-yl)-1H-benzimidazol-2-yl]benzoic acid methyl ester Formula: C19H18N4O2 MolecularWeight: 334.37182

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NCCCN4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NCCCN4

InChI

InChI=1S/C19H18N4O2/c1-25-19(24)13-5-3-12(4-6-13)18-22-15-8-7-14(11-16(15)23-18)17-20-9-2-10-21-17/h3-8,11H,2,9-10H2,1H3,(H,20,21)(H,22,23)