N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(5-propan-2-yl-1-benzofuran-3-yl)ethanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(5-propan-2-yl-1-benzofuran-3-yl)ethanamide Openeye Name: 2-(5-isopropylbenzofuran-3-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(5-propan-2-yl-3-benzofuranyl)acetamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(5-propan-2-yl-1-benzofuran-3-yl)acetamide Traditional Name: 2-(5-isopropylbenzofuran-3-yl)-N-(6-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)OC=C2CC(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)OC=C2CC(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H20N2O4S2/c1-12(2)13-4-7-18-16(8-13)14(11-27-18)9-20(24)23-21-22-17-6-5-15(29(3,25)26)10-19(17)28-21/h4-8,10-12H,9H2,1-3H3,(H,22,23,24)