[1-[(3-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(3-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 3H-benzimidazole-5-carboxylate Openeye Name: 1-[(3-methyl-2-pyridyl)carbamoyl]propyl 3H-benzimidazole-5-carboxylate CAS Name: 3H-benzimidazole-5-carboxylic acid [1-[(3-methyl-2-pyridinyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(3-methylpyridin-2-yl)amino]-1-oxobutan-2-yl] 3H-benzimidazole-5-carboxylate Traditional Name: 3H-benzimidazole-5-carboxylic acid 1-[(3-methyl-2-pyridyl)carbamoyl]propyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC=N1)C)OC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC=N1)C)OC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C18H18N4O3/c1-3-15(17(23)22-16-11(2)5-4-8-19-16)25-18(24)12-6-7-13-14(9-12)21-10-20-13/h4-10,15H,3H2,1-2H3,(H,20,21)(H,19,22,23)