N-[(2R)-1-[(4-fluorophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(2R)-1-[(4-fluorophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(1R)-1-[(4-fluorophenyl)carbamoyl]-3-methylsulfanyl-propyl]-3-morpholinosulfonyl-benzamide CAS Name: N-[(2R)-1-(4-fluoroanilino)-4-(methylthio)-1-oxobutan-2-yl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(2R)-1-(4-fluoroanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(1R)-1-[(4-fluorophenyl)carbamoyl]-3-(methylthio)propyl]-3-morpholinosulfonyl-benzamide Formula: C22H26FN3O5S2 MolecularWeight: 495.587343

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)F)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CSCC[C@H](C(=O)NC1=CC=C(C=C1)F)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H26FN3O5S2/c1-32-14-9-20(22(28)24-18-7-5-17(23)6-8-18)25-21(27)16-3-2-4-19(15-16)33(29,30)26-10-12-31-13-11-26/h2-8,15,20H,9-14H2,1H3,(H,24,28)(H,25,27)/t20-/m1/s1