methyl 2-[2-[3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]carbonylimino-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]carbonylimino-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[[3-(2,5-dioxo-1-pyrrolidinyl)phenyl]-oxomethyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-mesyl-2-(3-succinimidobenzoyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C22H19N3O7S2 MolecularWeight: 501.53216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC(=CC=C3)N4C(=O)CCC4=O

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC(=CC=C3)N4C(=O)CCC4=O

InChI

InChI=1S/C22H19N3O7S2/c1-32-20(28)12-24-16-7-6-15(34(2,30)31)11-17(16)33-22(24)23-21(29)13-4-3-5-14(10-13)25-18(26)8-9-19(25)27/h3-7,10-11H,8-9,12H2,1-2H3