N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(phenylmethyl)sulfonyl-ethanamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(phenylmethyl)sulfonyl-ethanamide Openeye Name: 2-benzylsulfonyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)acetamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-2-(phenylmethyl)sulfonylacetamide IUPAC Name: 2-benzylsulfonyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-benzylsulfonyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)acetamide Formula: C23H22N2O4S2 MolecularWeight: 454.56178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)N(CC3=CC=CO3)C(=O)CS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N(CC3=CC=CO3)C(=O)CS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4S2/c1-16-10-11-17(2)22-21(16)24-23(30-22)25(13-19-9-6-12-29-19)20(26)15-31(27,28)14-18-7-4-3-5-8-18/h3-12H,13-15H2,1-2H3