[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 2-[(4-methylthiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 2-[[(4-methyl-2-thiazolyl)thio]methyl]benzoic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 2-[[(4-methylthiazol-2-yl)thio]methyl]benzoic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1CSC2=NC(=CS2)C

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1CSC2=NC(=CS2)C

InChI

InChI=1S/C19H23N3O4S2/c1-3-4-9-20-18(25)22-16(23)10-26-17(24)15-8-6-5-7-14(15)12-28-19-21-13(2)11-27-19/h5-8,11H,3-4,9-10,12H2,1-2H3,(H2,20,22,23,25)