methyl 4-[2-[[5-(acetamidomethyl)thiophen-2-yl]sulfonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[5-(acetamidomethyl)thiophen-2-yl]sulfonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[5-(acetamidomethyl)-2-thienyl]sulfonylamino]ethyl]benzoate CAS Name: 4-[2-[[5-(acetamidomethyl)-2-thiophenyl]sulfonylamino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[5-(acetamidomethyl)thiophen-2-yl]sulfonylamino]ethyl]benzoate Traditional Name: 4-[2-[[5-(acetamidomethyl)-2-thienyl]sulfonylamino]ethyl]benzoic acid methyl ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H20N2O5S2/c1-12(20)18-11-15-7-8-16(25-15)26(22,23)19-10-9-13-3-5-14(6-4-13)17(21)24-2/h3-8,19H,9-11H2,1-2H3,(H,18,20)