N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-besyl-N-(4,6-difluoro-1,3-benzothiazol-2-yl)propionamide Formula: C16H12F2N2O3S2 MolecularWeight: 382.404886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(C=C(C=C3S2)F)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(C=C(C=C3S2)F)F

InChI

InChI=1S/C16H12F2N2O3S2/c17-10-8-12(18)15-13(9-10)24-16(20-15)19-14(21)6-7-25(22,23)11-4-2-1-3-5-11/h1-5,8-9H,6-7H2,(H,19,20,21)