N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(3-ethyl-6-methyl-1,3-benzothiazol-2-ylidene)-4-(p-tolylthio)butyramide Formula: C21H24N2OS2 MolecularWeight: 384.55806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C)SC1=NC(=O)CCCSC3=CC=C(C=C3)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C)SC1=NC(=O)CCCSC3=CC=C(C=C3)C

InChI

InChI=1S/C21H24N2OS2/c1-4-23-18-12-9-16(3)14-19(18)26-21(23)22-20(24)6-5-13-25-17-10-7-15(2)8-11-17/h7-12,14H,4-6,13H2,1-3H3