N-[6-[bis(fluoranyl)methoxy]-1,3-benzothiazol-2-yl]-3-naphthalen-2-ylsulfonyl-propanamide

Systemtic Name: N-[6-[bis(fluoranyl)methoxy]-1,3-benzothiazol-2-yl]-3-naphthalen-2-ylsulfonyl-propanamide Openeye Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-3-(2-naphthylsulfonyl)propanamide CAS Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-3-(2-naphthalenylsulfonyl)propanamide IUPAC Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-3-naphthalen-2-ylsulfonylpropanamide Traditional Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-3-(2-naphthylsulfonyl)propionamide Formula: C21H16F2N2O4S2 MolecularWeight: 462.489546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CCC(=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)F

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CCC(=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)F

InChI

InChI=1S/C21H16F2N2O4S2/c22-20(23)29-15-6-8-17-18(12-15)30-21(24-17)25-19(26)9-10-31(27,28)16-7-5-13-3-1-2-4-14(13)11-16/h1-8,11-12,20H,9-10H2,(H,24,25,26)