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

Systemtic Name: 4-(4-methoxyphenyl)sulfanyl-N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(4-methoxyphenyl)sulfanyl-N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-[(4-methoxyphenyl)thio]-N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]butanamide IUPAC Name: 4-(4-methoxyphenyl)sulfanyl-N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-[(4-methoxyphenyl)thio]-N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]butyramide Formula: C20H22N2O2S3 MolecularWeight: 418.59588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCCSC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N2O2S3/c1-22-17-11-10-16(25-3)13-18(17)27-20(22)21-19(23)5-4-12-26-15-8-6-14(24-2)7-9-15/h6-11,13H,4-5,12H2,1-3H3