tert-butyl 2-[2-chloranylsulfinyl-3-[(4-chlorophenyl)-ethanethioyl-amino]-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: tert-butyl 2-[2-chloranylsulfinyl-3-[(4-chlorophenyl)-ethanethioyl-amino]-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: tert-butyl 2-[3-(4-chloro-N-ethanethioyl-anilino)-2-chlorosulfinyl-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[3-[4-chloro-N-(1-sulfanylideneethyl)anilino]-2-chlorosulfinyl-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-(4-chloro-N-ethanethioylanilino)-2-chlorosulfinyl-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-chlorosulfinyl-3-(4-chloro-N-thioacetyl-anilino)-4-keto-azetidin-1-yl]-3-methyl-but-3-enoic acid tert-butyl ester Formula: C20H24Cl2N2O4S2 MolecularWeight: 491.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OC(C)(C)C)N1C(C(C1=O)N(C2=CC=C(C=C2)Cl)C(=S)C)S(=O)Cl

Isomeric SMILES

CC(=C)C(C(=O)OC(C)(C)C)N1C(C(C1=O)N(C2=CC=C(C=C2)Cl)C(=S)C)S(=O)Cl

InChI

InChI=1S/C20H24Cl2N2O4S2/c1-11(2)15(19(26)28-20(4,5)6)24-17(25)16(18(24)30(22)27)23(12(3)29)14-9-7-13(21)8-10-14/h7-10,15-16,18H,1H2,2-6H3