acetyloxymethyl 2-[2-chloranylsulfinyl-3-[2-(3-methylphenyl)ethanethioylamino]-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: acetyloxymethyl 2-[2-chloranylsulfinyl-3-[2-(3-methylphenyl)ethanethioylamino]-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: acetoxymethyl 2-[2-chlorosulfinyl-3-[[2-(m-tolyl)ethanethioyl]amino]-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[2-chlorosulfinyl-3-[[2-(3-methylphenyl)-1-sulfanylideneethyl]amino]-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 2-[2-chlorosulfinyl-3-[[2-(3-methylphenyl)ethanethioyl]amino]-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-chlorosulfinyl-4-keto-3-[[2-(m-tolyl)thioacetyl]amino]azetidin-1-yl]-3-methyl-but-3-enoic acid acetoxymethyl ester Formula: C20H23ClN2O6S2 MolecularWeight: 486.98942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=S)NC2C(N(C2=O)C(C(=C)C)C(=O)OCOC(=O)C)S(=O)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CC(=S)NC2C(N(C2=O)C(C(=C)C)C(=O)OCOC(=O)C)S(=O)Cl

InChI

InChI=1S/C20H23ClN2O6S2/c1-11(2)17(20(26)29-10-28-13(4)24)23-18(25)16(19(23)31(21)27)22-15(30)9-14-7-5-6-12(3)8-14/h5-8,16-17,19H,1,9-10H2,2-4H3,(H,22,30)