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

Systemtic Name: 2-[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-[(1S)-2-(4-ethylanilino)-1-methyl-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(1S)-2-(4-ethylanilino)-2-keto-1-methyl-ethyl]-4-methyl-thiazole-5-carboxylate Formula: C16H17N2O3S- MolecularWeight: 317.38278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)C2=NC(=C(S2)C(=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)C2=NC(=C(S2)C(=O)[O-])C

InChI

InChI=1S/C16H18N2O3S/c1-4-11-5-7-12(8-6-11)18-14(19)9(2)15-17-10(3)13(22-15)16(20)21/h5-9H,4H2,1-3H3,(H,18,19)(H,20,21)/p-1/t9-/m0/s1