[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate

Systemtic Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate Openeye Name: [2-(2-methoxyphenyl)thiazol-4-yl]methyl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate CAS Name: 4-(1,3-benzothiazol-2-ylthio)butanoic acid [2-(2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-ylthio)butyric acid [2-(2-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C22H20N2O3S3 MolecularWeight: 456.6008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=CS2)COC(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=CS2)COC(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N2O3S3/c1-26-18-9-4-2-7-16(18)21-23-15(14-29-21)13-27-20(25)11-6-12-28-22-24-17-8-3-5-10-19(17)30-22/h2-5,7-10,14H,6,11-13H2,1H3