[2-oxidanylidene-2-[2-(thiophen-2-ylsulfonylamino)-4,5-dihydroimidazol-1-yl]ethyl] 4-methylbenzoate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylsulfonylamino)-4,5-dihydroimidazol-1-yl]ethyl] 4-methylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienylsulfonylamino)-4,5-dihydroimidazol-1-yl]ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-oxo-2-[2-(thiophen-2-ylsulfonylamino)-4,5-dihydroimidazol-1-yl]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylsulfonylamino)-4,5-dihydroimidazol-1-yl]ethyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-keto-2-[2-(2-thienylsulfonylamino)-2-imidazolin-1-yl]ethyl] ester Formula: C17H17N3O5S2 MolecularWeight: 407.46398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(=O)N2CCN=C2NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC(=O)N2CCN=C2NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H17N3O5S2/c1-12-4-6-13(7-5-12)16(22)25-11-14(21)20-9-8-18-17(20)19-27(23,24)15-3-2-10-26-15/h2-7,10H,8-9,11H2,1H3,(H,18,19)