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

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-3-(4-methoxyphenyl)sulfonyl-propanamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propanamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonylpropanamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonylpropanamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propionamide Formula: C17H14F2N2O4S2 MolecularWeight: 412.430866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(C=C(C=C3S2)F)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(C=C(C=C3S2)F)F

InChI

InChI=1S/C17H14F2N2O4S2/c1-25-11-2-4-12(5-3-11)27(23,24)7-6-15(22)20-17-21-16-13(19)8-10(18)9-14(16)26-17/h2-5,8-9H,6-7H2,1H3,(H,20,21,22)