ethyl 3-(2-methylprop-2-enoylamino)-4-(2-pyridin-2-ylbenzimidazol-1-yl)benzoate

Systemtic Name: ethyl 3-(2-methylprop-2-enoylamino)-4-(2-pyridin-2-ylbenzimidazol-1-yl)benzoate Openeye Name: ethyl 3-(2-methylprop-2-enoylamino)-4-[2-(2-pyridyl)benzimidazol-1-yl]benzoate CAS Name: 3-[(2-methyl-1-oxoprop-2-enyl)amino]-4-[2-(2-pyridinyl)-1-benzimidazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-(2-methylprop-2-enoylamino)-4-(2-pyridin-2-ylbenzimidazol-1-yl)benzoate Traditional Name: 3-methacrylamido-4-[2-(2-pyridyl)benzimidazol-1-yl]benzoic acid ethyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2C3=CC=CC=C3N=C2C4=CC=CC=N4)NC(=O)C(=C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2C3=CC=CC=C3N=C2C4=CC=CC=N4)NC(=O)C(=C)C

InChI

InChI=1S/C25H22N4O3/c1-4-32-25(31)17-12-13-22(20(15-17)28-24(30)16(2)3)29-21-11-6-5-9-18(21)27-23(29)19-10-7-8-14-26-19/h5-15H,2,4H2,1,3H3,(H,28,30)