(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl thiophene-3-carboxylate

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl thiophene-3-carboxylate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl thiophene-3-carboxylate CAS Name: 3-thiophenecarboxylic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl thiophene-3-carboxylate Traditional Name: thiophene-3-carboxylic acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C19H21N3O5S2 MolecularWeight: 435.51714

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=CSC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=CSC=C4

InChI

InChI=1S/C19H21N3O5S2/c1-2-22-17-4-3-15(29(24,25)21-6-8-26-9-7-21)11-16(17)20-18(22)12-27-19(23)14-5-10-28-13-14/h3-5,10-11,13H,2,6-9,12H2,1H3