ethyl 3-(2-methylsulfanylethyl)-2-(2-naphthalen-1-ylethanoylimino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-methylsulfanylethyl)-2-(2-naphthalen-1-ylethanoylimino)-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-methylsulfanylethyl)-2-[2-(1-naphthyl)acetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-[2-(methylthio)ethyl]-2-[2-(1-naphthalenyl)-1-oxoethyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-methylsulfanylethyl)-2-(2-naphthalen-1-ylacetyl)imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-[2-(methylthio)ethyl]-2-[2-(1-naphthyl)acetyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C25H24N2O3S2 MolecularWeight: 464.59966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)CC3=CC=CC4=CC=CC=C43)S2)CCSC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)CC3=CC=CC4=CC=CC=C43)S2)CCSC

InChI

InChI=1S/C25H24N2O3S2/c1-3-30-24(29)19-11-12-21-22(15-19)32-25(27(21)13-14-31-2)26-23(28)16-18-9-6-8-17-7-4-5-10-20(17)18/h4-12,15H,3,13-14,16H2,1-2H3