ethyl 3-[(2-chloranylpyridin-4-yl)carbonylamino]-4-(5,6-dimethylbenzimidazol-1-yl)benzoate

Systemtic Name: ethyl 3-[(2-chloranylpyridin-4-yl)carbonylamino]-4-(5,6-dimethylbenzimidazol-1-yl)benzoate Openeye Name: ethyl 3-[(2-chloropyridine-4-carbonyl)amino]-4-(5,6-dimethylbenzimidazol-1-yl)benzoate CAS Name: 3-[[(2-chloro-4-pyridinyl)-oxomethyl]amino]-4-(5,6-dimethyl-1-benzimidazolyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-chloropyridine-4-carbonyl)amino]-4-(5,6-dimethylbenzimidazol-1-yl)benzoate Traditional Name: 3-[(2-chloroisonicotinoyl)amino]-4-(5,6-dimethylbenzimidazol-1-yl)benzoic acid ethyl ester Formula: C24H21ClN4O3 MolecularWeight: 448.90154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2C=NC3=C2C=C(C(=C3)C)C)NC(=O)C4=CC(=NC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2C=NC3=C2C=C(C(=C3)C)C)NC(=O)C4=CC(=NC=C4)Cl

InChI

InChI=1S/C24H21ClN4O3/c1-4-32-24(31)17-5-6-20(29-13-27-18-9-14(2)15(3)10-21(18)29)19(11-17)28-23(30)16-7-8-26-22(25)12-16/h5-13H,4H2,1-3H3,(H,28,30)