ethyl 2-[2-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(3-methylsulfonylanilino)-2-oxo-ethyl]sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[[2-(3-methylsulfonylanilino)-2-oxoethyl]thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(3-methylsulfonylanilino)-2-oxoethyl]sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-keto-2-(3-mesylanilino)ethyl]thio]thiazol-4-yl]acetic acid ethyl ester Formula: C16H18N2O5S3 MolecularWeight: 414.51952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C16H18N2O5S3/c1-3-23-15(20)8-12-9-24-16(18-12)25-10-14(19)17-11-5-4-6-13(7-11)26(2,21)22/h4-7,9H,3,8,10H2,1-2H3,(H,17,19)