3,4,5-trimethoxy-N-[(2R)-4-methylsulfanyl-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[(2R)-4-methylsulfanyl-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[(1R)-3-methylsulfanyl-1-[(4-morpholinophenyl)carbamoyl]propyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[(2R)-4-(methylthio)-1-[4-(4-morpholinyl)anilino]-1-oxobutan-2-yl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[(2R)-4-methylsulfanyl-1-(4-morpholin-4-ylanilino)-1-oxobutan-2-yl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[(1R)-3-(methylthio)-1-[(4-morpholinophenyl)carbamoyl]propyl]benzamide Formula: C25H33N3O6S MolecularWeight: 503.61102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(CCSC)C(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N[C@H](CCSC)C(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C25H33N3O6S/c1-31-21-15-17(16-22(32-2)23(21)33-3)24(29)27-20(9-14-35-4)25(30)26-18-5-7-19(8-6-18)28-10-12-34-13-11-28/h5-8,15-16,20H,9-14H2,1-4H3,(H,26,30)(H,27,29)/t20-/m1/s1