N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(4-methylsulfonylphenyl)ethanamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-2-(4-methylsulfonylphenyl)acetamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-2-(4-methylsulfonylphenyl)acetamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(4-methylsulfonylphenyl)acetamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-2-(4-mesylphenyl)acetamide Formula: C22H19ClN2O4S2 MolecularWeight: 474.98026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C)Cl

InChI

InChI=1S/C22H19ClN2O4S2/c1-14-10-16(23)12-19-21(14)24-22(30-19)25(13-17-4-3-9-29-17)20(26)11-15-5-7-18(8-6-15)31(2,27)28/h3-10,12H,11,13H2,1-2H3