[2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-(N-methylanilino)-2-oxo-ethyl] 2-(isopentylamino)thiazole-4-carboxylate CAS Name: 2-(3-methylbutylamino)-4-thiazolecarboxylic acid [2-(N-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(N-methylanilino)-2-oxoethyl] 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(isoamylamino)thiazole-4-carboxylic acid [2-keto-2-(N-methylanilino)ethyl] ester Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C(=O)OCC(=O)N(C)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C(=O)OCC(=O)N(C)C2=CC=CC=C2

InChI

InChI=1S/C18H23N3O3S/c1-13(2)9-10-19-18-20-15(12-25-18)17(23)24-11-16(22)21(3)14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3,(H,19,20)