methyl (3E)-3-(1-tert-butylsulfinamoyl-2-methoxy-2-oxidanylidene-ethylidene)-4-iodanylsulfanyl-2-methyl-1,1-bis(oxidanylidene)-1,2-thiazole-5-carboxylate

Systemtic Name: methyl (3E)-3-(1-tert-butylsulfinamoyl-2-methoxy-2-oxidanylidene-ethylidene)-4-iodanylsulfanyl-2-methyl-1,1-bis(oxidanylidene)-1,2-thiazole-5-carboxylate Openeye Name: methyl (3E)-3-(1-tert-butylsulfinamoyl-2-methoxy-2-oxo-ethylidene)-4-iodosulfanyl-2-methyl-1,1-dioxo-isothiazole-5-carboxylate CAS Name: (3E)-3-(1-tert-butylsulfinamoyl-2-methoxy-2-oxoethylidene)-4-(iodothio)-2-methyl-1,1-dioxo-5-isothiazolecarboxylic acid methyl ester IUPAC Name: methyl (3E)-3-(1-tert-butylsulfinamoyl-2-methoxy-2-oxoethylidene)-4-iodosulfanyl-2-methyl-1,1-dioxo-1,2-thiazole-5-carboxylate Traditional Name: (3E)-3-(1-tert-butylsulfinamoyl-2-keto-2-methoxy-ethylidene)-4-(iodothio)-1,1-diketo-2-methyl-isothiazole-5-carboxylic acid methyl ester Formula: C13H19IN2O7S3 MolecularWeight: 538.39863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)C(=C1C(=C(S(=O)(=O)N1C)C(=O)OC)SI)C(=O)OC

Isomeric SMILES

CC(C)(C)NS(=O)/C(=C/1\C(=C(S(=O)(=O)N1C)C(=O)OC)SI)/C(=O)OC

InChI

InChI=1S/C13H19IN2O7S3/c1-13(2,3)15-25(19)9(11(17)22-5)7-8(24-14)10(12(18)23-6)26(20,21)16(7)4/h15H,1-6H3/b9-7+