N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)propanamide

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propanamide CAS Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonylpropanamide Traditional Name: N-benzyl-N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfonyl-propionamide Formula: C24H21FN2O4S2 MolecularWeight: 484.562943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=CC=C4S3)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=CC=C4S3)F

InChI

InChI=1S/C24H21FN2O4S2/c1-31-18-10-12-19(13-11-18)33(29,30)15-14-22(28)27(16-17-6-3-2-4-7-17)24-26-23-20(25)8-5-9-21(23)32-24/h2-13H,14-16H2,1H3