2-methoxy-N-[(2R)-4-methylsulfanyl-1-[[4-(methylsulfonylamino)phenyl]amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[(2R)-4-methylsulfanyl-1-[[4-(methylsulfonylamino)phenyl]amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1R)-1-[[4-(methanesulfonamido)phenyl]carbamoyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[(2R)-1-[4-(methanesulfonamido)anilino]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[(2R)-1-[4-(methanesulfonamido)anilino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[(1R)-1-[[4-(methanesulfonamido)phenyl]carbamoyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NC2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1C(=O)N[C@H](CCSC)C(=O)NC2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C20H25N3O5S2/c1-28-18-7-5-4-6-16(18)19(24)22-17(12-13-29-2)20(25)21-14-8-10-15(11-9-14)23-30(3,26)27/h4-11,17,23H,12-13H2,1-3H3,(H,21,25)(H,22,24)/t17-/m1/s1