2-(2,4-dimethylphenyl)-N-(furan-2-ylmethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(2,4-dimethylphenyl)-N-(furan-2-ylmethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(2,4-dimethylphenyl)-N-(2-furylmethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(2,4-dimethylphenyl)-N-(2-furanylmethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(2,4-dimethylphenyl)-N-(furan-2-ylmethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(2,4-dimethylphenyl)-N-(2-furfuryl)-N-(6-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C23H22N2O4S2 MolecularWeight: 454.56178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)CC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C

InChI

InChI=1S/C23H22N2O4S2/c1-15-6-7-17(16(2)11-15)12-22(26)25(14-18-5-4-10-29-18)23-24-20-9-8-19(31(3,27)28)13-21(20)30-23/h4-11,13H,12,14H2,1-3H3