2-[[3-tert-butylsulfanyl-2-[(3E)-3-hydroxyimino-2,2-dimethyl-propyl]-5-propan-2-yl-indol-1-yl]methyl]cyclohexa-2,4-diene-1-thione

Systemtic Name: 2-[[3-tert-butylsulfanyl-2-[(3E)-3-hydroxyimino-2,2-dimethyl-propyl]-5-propan-2-yl-indol-1-yl]methyl]cyclohexa-2,4-diene-1-thione Openeye Name: (1E)-3-[3-tert-butylsulfanyl-5-isopropyl-1-[(6-thioxocyclohexa-1,3-dien-1-yl)methyl]indol-2-yl]-2,2-dimethyl-propanal oxime CAS Name: (1E)-3-[3-(tert-butylthio)-5-propan-2-yl-1-[(6-sulfanylidene-1-cyclohexa-1,3-dienyl)methyl]-2-indolyl]-2,2-dimethylpropanal oxime IUPAC Name: 2-[[3-tert-butylsulfanyl-2-[(3E)-3-hydroxyimino-2,2-dimethylpropyl]-5-propan-2-ylindol-1-yl]methyl]cyclohexa-2,4-diene-1-thione Traditional Name: (1E)-3-[3-(tert-butylthio)-5-isopropyl-1-[(6-thioxocyclohexa-1,3-dien-1-yl)methyl]indol-2-yl]-2,2-dimethyl-propionaldoxime Formula: C27H36N2OS2 MolecularWeight: 468.71754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=C2SC(C)(C)C)CC(C)(C)C=NO)CC3=CC=CCC3=S

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=C2SC(C)(C)C)CC(C)(C)/C=N/O)CC3=CC=CCC3=S

InChI

InChI=1S/C27H36N2OS2/c1-18(2)19-12-13-22-21(14-19)25(32-26(3,4)5)23(15-27(6,7)17-28-30)29(22)16-20-10-8-9-11-24(20)31/h8-10,12-14,17-18,30H,11,15-16H2,1-7H3/b28-17+