N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: N-(6-mesyl-3-methyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C13H16N2O3S2 MolecularWeight: 312.40774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)C)C

Isomeric SMILES

CCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)C)C

InChI

InChI=1S/C13H16N2O3S2/c1-4-5-12(16)14-13-15(2)10-7-6-9(20(3,17)18)8-11(10)19-13/h6-8H,4-5H2,1-3H3