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

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 4-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 4-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 4-[(2-methylthiazol-4-yl)methoxy]benzoic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=C(C=C2)C(=O)OCC(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=C(C=C2)C(=O)OCC(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C20H25N3O5S/c1-13(2)8-9-21-20(26)23-18(24)11-28-19(25)15-4-6-17(7-5-15)27-10-16-12-29-14(3)22-16/h4-7,12-13H,8-11H2,1-3H3,(H2,21,23,24,26)