dimethyl 5-[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[4-(1,3-benzothiazol-2-yl)-1-oxobutoxy]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H22N2O7S2 MolecularWeight: 490.54928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CCCC2=NC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CCCC2=NC3=CC=CC=C3S2)C(=O)OC

InChI

InChI=1S/C22H22N2O7S2/c1-12-18(21(27)29-2)20(33-19(12)22(28)30-3)24-15(25)11-31-17(26)10-6-9-16-23-13-7-4-5-8-14(13)32-16/h4-5,7-8H,6,9-11H2,1-3H3,(H,24,25)