[3-[(3-chloranyl-2-methyl-phenyl)carbamothioylhydrazinylidene]-2-oxidanylidene-indol-1-yl]methyl-cyclohexyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [3-[(3-chloranyl-2-methyl-phenyl)carbamothioylhydrazinylidene]-2-oxidanylidene-indol-1-yl]methyl-cyclohexyl-[(4-methylphenyl)methyl]azanium Openeye Name: [3-[(3-chloro-2-methyl-phenyl)carbamothioylhydrazono]-2-oxo-indolin-1-yl]methyl-cyclohexyl-(p-tolylmethyl)ammonium CAS Name: [3-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]hydrazinylidene]-2-oxo-1-indolyl]methyl-cyclohexyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [3-[(3-chloro-2-methylphenyl)carbamothioylhydrazinylidene]-2-oxoindol-1-yl]methyl-cyclohexyl-[(4-methylphenyl)methyl]azanium Traditional Name: [3-[(3-chloro-2-methyl-phenyl)thiocarbamoylhydrazono]-2-keto-indolin-1-yl]methyl-cyclohexyl-(4-methylbenzyl)ammonium Formula: C31H35ClN5OS+ MolecularWeight: 561.1605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](CN2C3=CC=CC=C3C(=NNC(=S)NC4=C(C(=CC=C4)Cl)C)C2=O)C5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](CN2C3=CC=CC=C3C(=NNC(=S)NC4=C(C(=CC=C4)Cl)C)C2=O)C5CCCCC5

InChI

InChI=1S/C31H34ClN5OS/c1-21-15-17-23(18-16-21)19-36(24-9-4-3-5-10-24)20-37-28-14-7-6-11-25(28)29(30(37)38)34-35-31(39)33-27-13-8-12-26(32)22(27)2/h6-8,11-18,24H,3-5,9-10,19-20H2,1-2H3,(H2,33,35,39)/p+1