2-[3-[(4-methylsulfanyl-1H-indazol-5-yl)oxy]cyclohexyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[(4-methylsulfanyl-1H-indazol-5-yl)oxy]cyclohexyl]isoindole-1,3-dione Openeye Name: 2-[3-[(4-methylsulfanyl-1H-indazol-5-yl)oxy]cyclohexyl]isoindoline-1,3-dione CAS Name: 2-[3-[[4-(methylthio)-1H-indazol-5-yl]oxy]cyclohexyl]isoindole-1,3-dione IUPAC Name: 2-[3-[(4-methylsulfanyl-1H-indazol-5-yl)oxy]cyclohexyl]isoindole-1,3-dione Traditional Name: 2-[3-[[4-(methylthio)-1H-indazol-5-yl]oxy]cyclohexyl]isoindoline-1,3-quinone Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC2=C1C=NN2)OC3CCCC(C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CSC1=C(C=CC2=C1C=NN2)OC3CCCC(C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H21N3O3S/c1-29-20-17-12-23-24-18(17)9-10-19(20)28-14-6-4-5-13(11-14)25-21(26)15-7-2-3-8-16(15)22(25)27/h2-3,7-10,12-14H,4-6,11H2,1H3,(H,23,24)