dimethyl 2-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[4-(1,3-benzothiazol-2-yl)piperidino]acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H25N3O5S/c1-31-23(29)16-7-8-17(24(30)32-2)19(13-16)25-21(28)14-27-11-9-15(10-12-27)22-26-18-5-3-4-6-20(18)33-22/h3-8,13,15H,9-12,14H2,1-2H3,(H,25,28)