[1-[methyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate

Systemtic Name: [1-[methyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: [1-methyl-2-(N-methylanilino)-2-oxo-ethyl] 5-amino-3-methyl-isothiazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isothiazolecarboxylic acid [1-(N-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(N-methylanilino)-1-oxopropan-2-yl] 5-amino-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isothiazole-4-carboxylic acid [2-keto-1-methyl-2-(N-methylanilino)ethyl] ester Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OC(C)C(=O)N(C)C2=CC=CC=C2)N

Isomeric SMILES

CC1=NSC(=C1C(=O)OC(C)C(=O)N(C)C2=CC=CC=C2)N

InChI

InChI=1S/C15H17N3O3S/c1-9-12(13(16)22-17-9)15(20)21-10(2)14(19)18(3)11-7-5-4-6-8-11/h4-8,10H,16H2,1-3H3