N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-2-(4-ethanoylphenoxy)ethanamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-2-(4-ethanoylphenoxy)ethanamide Openeye Name: 2-(4-acetylphenoxy)-N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]acetamide CAS Name: 2-(4-acetylphenoxy)-N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]acetamide IUPAC Name: 2-(4-acetylphenoxy)-N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(4-acetylphenoxy)-N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]acetamide Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)COC2=CC=C(C=C2)C(=O)C)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)COC2=CC=C(C=C2)C(=O)C)SCC(=O)N

InChI

InChI=1S/C16H17N3O4S2/c1-9-15(24-8-13(17)21)25-16(18-9)19-14(22)7-23-12-5-3-11(4-6-12)10(2)20/h3-6H,7-8H2,1-2H3,(H2,17,21)(H,18,19,22)