N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-ethanamide

Systemtic Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-ethanamide Openeye Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-acetamide CAS Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonylacetamide IUPAC Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonylacetamide Traditional Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)sulfonyl-acetamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC)S2)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC)S2)C

InChI

InChI=1S/C21H24N2O4S2/c1-4-5-6-15-7-12-18-19(13-15)28-21(23(18)2)22-20(24)14-29(25,26)17-10-8-16(27-3)9-11-17/h7-13H,4-6,14H2,1-3H3