[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: 2-(2-furoylamino)-3-methyl-butyric acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C(C(C)C)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C(C(C)C)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H22N2O4S/c1-13(2)18(23-19(24)17-5-4-10-26-17)21(25)27-11-16-12-28-20(22-16)15-8-6-14(3)7-9-15/h4-10,12-13,18H,11H2,1-3H3,(H,23,24)