[2-[2-(4-methoxyphenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-[2-(4-methoxyphenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-[2-(4-methoxybenzoyl)hydrazino]-2-oxo-ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-[[(4-methoxyphenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methoxybenzoyl)hydrazinyl]-2-oxoethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-keto-2-(N'-p-anisoylhydrazino)ethyl] ester Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NNC(=O)COC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NNC(=O)COC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C18H15N3O5S/c1-25-13-5-2-11(3-6-13)17(23)21-20-16(22)9-26-18(24)12-4-7-14-15(8-12)27-10-19-14/h2-8,10H,9H2,1H3,(H,20,22)(H,21,23)