methyl 2-[(2-acetamido-1,3-thiazol-4-yl)carbonylamino]-2-methyl-pentanoate

Systemtic Name: methyl 2-[(2-acetamido-1,3-thiazol-4-yl)carbonylamino]-2-methyl-pentanoate Openeye Name: methyl 2-[(2-acetamidothiazole-4-carbonyl)amino]-2-methyl-pentanoate CAS Name: 2-[[(2-acetamido-4-thiazolyl)-oxomethyl]amino]-2-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(2-acetamido-1,3-thiazole-4-carbonyl)amino]-2-methylpentanoate Traditional Name: 2-[(2-acetamidothiazole-4-carbonyl)amino]-2-methyl-valeric acid methyl ester Formula: C13H19N3O4S MolecularWeight: 313.37266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)OC)NC(=O)C1=CSC(=N1)NC(=O)C

Isomeric SMILES

CCCC(C)(C(=O)OC)NC(=O)C1=CSC(=N1)NC(=O)C

InChI

InChI=1S/C13H19N3O4S/c1-5-6-13(3,11(19)20-4)16-10(18)9-7-21-12(15-9)14-8(2)17/h7H,5-6H2,1-4H3,(H,16,18)(H,14,15,17)