ethyl 4-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C21H23N3O4S/c1-3-28-20(26)15-8-10-16(11-9-15)22-19(25)14-29-21-23-17-6-4-5-7-18(17)24(21)12-13-27-2/h4-11H,3,12-14H2,1-2H3,(H,22,25)