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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCCC(=O)NC2=NC3=C(S2)C=CC=C3SC

Isomeric SMILES

COC1=CC=C(C=C1)SCCCC(=O)NC2=NC3=C(S2)C=CC=C3SC

InChI

InChI=1S/C19H20N2O2S3/c1-23-13-8-10-14(11-9-13)25-12-4-7-17(22)20-19-21-18-15(24-2)5-3-6-16(18)26-19/h3,5-6,8-11H,4,7,12H2,1-2H3,(H,20,21,22)