[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]benzoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 2-[(2-thiazolin-2-ylthio)methyl]benzoic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1CSC2=NCCS2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1CSC2=NCCS2

InChI

InChI=1S/C19H25N3O4S2/c1-13(2)7-8-20-18(25)22-16(23)11-26-17(24)15-6-4-3-5-14(15)12-28-19-21-9-10-27-19/h3-6,13H,7-12H2,1-2H3,(H2,20,22,23,25)