S-[3-[(2,3-dimethoxyphenyl)methyl-methylsulfonyl-amino]-2-methyl-3-oxidanylidene-propyl] ethanethioate

Systemtic Name: S-[3-[(2,3-dimethoxyphenyl)methyl-methylsulfonyl-amino]-2-methyl-3-oxidanylidene-propyl] ethanethioate Openeye Name: S-[3-[(2,3-dimethoxyphenyl)methyl-methylsulfonyl-amino]-2-methyl-3-oxo-propyl] ethanethioate CAS Name: ethanethioic acid S-[3-[(2,3-dimethoxyphenyl)methyl-methylsulfonylamino]-2-methyl-3-oxopropyl] ester IUPAC Name: S-[3-[(2,3-dimethoxyphenyl)methyl-methylsulfonylamino]-2-methyl-3-oxopropyl] ethanethioate Traditional Name: ethanethioic acid S-[3-keto-3-[mesyl(o-veratryl)amino]-2-methyl-propyl] ester Formula: C16H23NO6S2 MolecularWeight: 389.48692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N(CC1=C(C(=CC=C1)OC)OC)S(=O)(=O)C

Isomeric SMILES

CC(CSC(=O)C)C(=O)N(CC1=C(C(=CC=C1)OC)OC)S(=O)(=O)C

InChI

InChI=1S/C16H23NO6S2/c1-11(10-24-12(2)18)16(19)17(25(5,20)21)9-13-7-6-8-14(22-3)15(13)23-4/h6-8,11H,9-10H2,1-5H3