4-(4-methoxyphenyl)sulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide

Systemtic Name: 4-(4-methoxyphenyl)sulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide Openeye Name: 4-(4-methoxyphenyl)sulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide CAS Name: 4-[(4-methoxyphenyl)thio]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]butanamide IUPAC Name: 4-(4-methoxyphenyl)sulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide Traditional Name: 4-[(4-methoxyphenyl)thio]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]butyramide Formula: C19H20N2O2S3 MolecularWeight: 404.5693

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

COC1=CC=C(C=C1)SCCCC(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C19H20N2O2S3/c1-23-14-6-8-15(9-7-14)25-11-3-4-18(22)20-13-5-10-16-17(12-13)26-19(21-16)24-2/h5-10,12H,3-4,11H2,1-2H3,(H,20,22)