[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)NC

InChI

InChI=1S/C17H19N3O3S/c1-10-13(16(18-2)24-20-10)17(22)23-14(11-6-4-3-5-7-11)15(21)19-12-8-9-12/h3-7,12,14,18H,8-9H2,1-2H3,(H,19,21)