methyl 1-[4-[(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4-[(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-[(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-[[(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)amino]-oxomethyl]phenyl]sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-[(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylisonipecotic acid methyl ester Formula: C24H27N3O6S2 MolecularWeight: 517.61768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)C(=O)OC)N2C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)C(=O)OC)N2C

InChI

InChI=1S/C24H27N3O6S2/c1-4-33-19-6-5-7-20-21(19)26(2)24(34-20)25-22(28)16-8-10-18(11-9-16)35(30,31)27-14-12-17(13-15-27)23(29)32-3/h5-11,17H,4,12-15H2,1-3H3