ethyl 3-(2-ethoxyethyl)-2-[4-(4-methylphenyl)sulfanylbutanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-ethoxyethyl)-2-[4-(4-methylphenyl)sulfanylbutanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-ethoxyethyl)-2-[4-(p-tolylsulfanyl)butanoylimino]-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxyethyl)-2-[4-[(4-methylphenyl)thio]-1-oxobutyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-ethoxyethyl)-2-[4-(4-methylphenyl)sulfanylbutanoylimino]-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxyethyl)-2-[4-(p-tolylthio)butanoylimino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C25H30N2O4S2 MolecularWeight: 486.6467

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CCCSC3=CC=C(C=C3)C

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CCCSC3=CC=C(C=C3)C

InChI

InChI=1S/C25H30N2O4S2/c1-4-30-15-14-27-21-13-10-19(24(29)31-5-2)17-22(21)33-25(27)26-23(28)7-6-16-32-20-11-8-18(3)9-12-20/h8-13,17H,4-7,14-16H2,1-3H3