ethyl 2-[1-(4-ethoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-1,3-benzothiazole-5-carboxylate

Systemtic Name: ethyl 2-[1-(4-ethoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-1,3-benzothiazole-5-carboxylate Openeye Name: ethyl 2-[1-(4-ethoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-1,3-benzothiazole-5-carboxylate CAS Name: 2-[[1-(4-ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-1,3-benzothiazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-1,3-benzothiazole-5-carboxylate Traditional Name: 2-[(2,5-diketo-1-p-phenetyl-pyrrolidin-3-yl)thio]-1,3-benzothiazole-5-carboxylic acid ethyl ester Formula: C22H20N2O5S2 MolecularWeight: 456.5346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=NC4=C(S3)C=CC(=C4)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=NC4=C(S3)C=CC(=C4)C(=O)OCC

InChI

InChI=1S/C22H20N2O5S2/c1-3-28-15-8-6-14(7-9-15)24-19(25)12-18(20(24)26)31-22-23-16-11-13(21(27)29-4-2)5-10-17(16)30-22/h5-11,18H,3-4,12H2,1-2H3