S-[[2-methyl-5-[2-(phenylsulfonyl)ethylsulfanyl]-1,3-thiazol-4-yl]methyl] ethanethioate

Systemtic Name: S-[[2-methyl-5-[2-(phenylsulfonyl)ethylsulfanyl]-1,3-thiazol-4-yl]methyl] ethanethioate Openeye Name: S-[[5-[2-(benzenesulfonyl)ethylsulfanyl]-2-methyl-thiazol-4-yl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[5-[2-(benzenesulfonyl)ethylthio]-2-methyl-4-thiazolyl]methyl] ester IUPAC Name: S-[[5-[2-(benzenesulfonyl)ethylsulfanyl]-2-methyl-1,3-thiazol-4-yl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[[5-(2-besylethylthio)-2-methyl-thiazol-4-yl]methyl] ester Formula: C15H17NO3S4 MolecularWeight: 387.56038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)SCCS(=O)(=O)C2=CC=CC=C2)CSC(=O)C

Isomeric SMILES

CC1=NC(=C(S1)SCCS(=O)(=O)C2=CC=CC=C2)CSC(=O)C

InChI

InChI=1S/C15H17NO3S4/c1-11-16-14(10-21-12(2)17)15(22-11)20-8-9-23(18,19)13-6-4-3-5-7-13/h3-7H,8-10H2,1-2H3