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

Systemtic Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)ethanamide Openeye Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)acetamide CAS Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)acetamide IUPAC Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)acetamide Traditional Name: N-(6-butyl-3-methyl-1,3-benzothiazol-2-ylidene)-2-(4-mesylphenyl)acetamide Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)CC3=CC=C(C=C3)S(=O)(=O)C)S2)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)CC3=CC=C(C=C3)S(=O)(=O)C)S2)C

InChI

InChI=1S/C21H24N2O3S2/c1-4-5-6-15-9-12-18-19(13-15)27-21(23(18)2)22-20(24)14-16-7-10-17(11-8-16)28(3,25)26/h7-13H,4-6,14H2,1-3H3