N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(phenylsulfonylmethyl)furan-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=C(OC=C2)C(=O)NCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=C(OC=C2)C(=O)NCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N2O4S2/c24-21(22-12-10-19-23-17-8-4-5-9-18(17)28-19)20-15(11-13-27-20)14-29(25,26)16-6-2-1-3-7-16/h1-9,11,13H,10,12,14H2,(H,22,24)