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

Systemtic Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-pentoxy-benzamide Openeye Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-pentoxy-benzamide CAS Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-pentoxybenzamide IUPAC Name: N-(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-pentoxybenzamide Traditional Name: 3-amoxy-N-(6-mesyl-3-methyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)C

InChI

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