N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonylmethyl)furan-2-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonylmethyl)furan-2-carboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)furan-2-carboxamide CAS Name: 3-(benzenesulfonylmethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-furancarboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)furan-2-carboxamide Traditional Name: 3-(besylmethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-furamide Formula: C21H18N2O4S2 MolecularWeight: 426.50862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C21H18N2O4S2/c1-13-10-14(2)18-17(11-13)28-21(22-18)23-20(24)19-15(8-9-27-19)12-29(25,26)16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H,22,23,24)