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

Systemtic Name: 2-[2-[(4-ethylphenyl)methylamino]-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-[2-[(4-ethylphenyl)methylamino]-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[2-[(4-ethylphenyl)methylamino]-2-oxoethyl]-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-[2-[(4-ethylphenyl)methylamino]-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-[(4-ethylbenzyl)amino]-2-keto-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)CNC(=O)CC2=NC(=C(S2)C(=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)CC2=NC(=C(S2)C(=O)[O-])C

InChI

InChI=1S/C16H18N2O3S/c1-3-11-4-6-12(7-5-11)9-17-13(19)8-14-18-10(2)15(22-14)16(20)21/h4-7H,3,8-9H2,1-2H3,(H,17,19)(H,20,21)/p-1