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

Systemtic Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-4-methyl-thiazole-5-carboxylate Formula: C14H12ClN2O3S- MolecularWeight: 323.77468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC(=O)NCC2=CC=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)CC(=O)NCC2=CC=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C14H13ClN2O3S/c1-8-13(14(19)20)21-12(17-8)6-11(18)16-7-9-2-4-10(15)5-3-9/h2-5H,6-7H2,1H3,(H,16,18)(H,19,20)/p-1