methyl 4-chloranyl-2-[2-(2-phenethylbenzimidazol-1-yl)ethylcarbamoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[2-(2-phenethylbenzimidazol-1-yl)ethylcarbamoylamino]benzoate Openeye Name: methyl 4-chloro-2-[2-(2-phenethylbenzimidazol-1-yl)ethylcarbamoylamino]benzoate CAS Name: 4-chloro-2-[[oxo-[2-(2-phenethyl-1-benzimidazolyl)ethylamino]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[2-(2-phenethylbenzimidazol-1-yl)ethylcarbamoylamino]benzoate Traditional Name: 4-chloro-2-[2-(2-phenethylbenzimidazol-1-yl)ethylcarbamoylamino]benzoic acid methyl ester Formula: C26H25ClN4O3 MolecularWeight: 476.9547

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)NCCN2C3=CC=CC=C3N=C2CCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)NCCN2C3=CC=CC=C3N=C2CCC4=CC=CC=C4

InChI

InChI=1S/C26H25ClN4O3/c1-34-25(32)20-13-12-19(27)17-22(20)30-26(33)28-15-16-31-23-10-6-5-9-21(23)29-24(31)14-11-18-7-3-2-4-8-18/h2-10,12-13,17H,11,14-16H2,1H3,(H2,28,30,33)