diethyl 5-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)N2CCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)N2CCCC2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H25N3O5S2/c1-4-30-21(27)17-13(3)18(22(28)31-5-2)33-20(17)25-23(29)26-12-8-10-15(26)19-24-14-9-6-7-11-16(14)32-19/h6-7,9,11,15H,4-5,8,10,12H2,1-3H3,(H,25,29)