(3E)-3-[(4-methylsulfanyl-2-oxidanyl-phenyl)methylidene]-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1H-indol-2-one

Systemtic Name: (3E)-3-[(4-methylsulfanyl-2-oxidanyl-phenyl)methylidene]-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1H-indol-2-one Openeye Name: (3E)-4-[2-hydroxy-3-(isopropylamino)propoxy]-3-[(2-hydroxy-4-methylsulfanyl-phenyl)methylene]indolin-2-one CAS Name: (3E)-3-[[2-hydroxy-4-(methylthio)phenyl]methylidene]-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1H-indol-2-one IUPAC Name: (3E)-3-[(2-hydroxy-4-methylsulfanylphenyl)methylidene]-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1H-indol-2-one Traditional Name: (3E)-4-[2-hydroxy-3-(isopropylamino)propoxy]-3-[2-hydroxy-4-(methylthio)benzylidene]oxindole Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC2=C1C(=CC3=C(C=C(C=C3)SC)O)C(=O)N2)O

Isomeric SMILES

CC(C)NCC(COC1=CC=CC2=C1/C(=C\C3=C(C=C(C=C3)SC)O)/C(=O)N2)O

InChI

InChI=1S/C22H26N2O4S/c1-13(2)23-11-15(25)12-28-20-6-4-5-18-21(20)17(22(27)24-18)9-14-7-8-16(29-3)10-19(14)26/h4-10,13,15,23,25-26H,11-12H2,1-3H3,(H,24,27)/b17-9+