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

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl 3-acetamidobenzoate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C23H26N4O6S MolecularWeight: 486.54074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O6S/c1-3-27-21-8-7-19(34(30,31)26-9-11-32-12-10-26)14-20(21)25-22(27)15-33-23(29)17-5-4-6-18(13-17)24-16(2)28/h4-8,13-14H,3,9-12,15H2,1-2H3,(H,24,28)