[(4E)-4-(carbamothioylhydrazinylidene)-4-phenyl-butyl] N-(4-butylphenyl)carbamate

Systemtic Name: [(4E)-4-(carbamothioylhydrazinylidene)-4-phenyl-butyl] N-(4-butylphenyl)carbamate Openeye Name: [(4E)-4-(carbamothioylhydrazono)-4-phenyl-butyl] N-(4-butylphenyl)carbamate CAS Name: N-(4-butylphenyl)carbamic acid [(4E)-4-(carbamothioylhydrazinylidene)-4-phenylbutyl] ester IUPAC Name: [(4E)-4-(carbamothioylhydrazinylidene)-4-phenylbutyl] N-(4-butylphenyl)carbamate Traditional Name: N-(4-butylphenyl)carbamic acid [(4E)-4-phenyl-4-(thiocarbamoylhydrazono)butyl] ester Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)OCCCC(=NNC(=S)N)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)OCCC/C(=N\NC(=S)N)/C2=CC=CC=C2

InChI

InChI=1S/C22H28N4O2S/c1-2-3-8-17-12-14-19(15-13-17)24-22(27)28-16-7-11-20(25-26-21(23)29)18-9-5-4-6-10-18/h4-6,9-10,12-15H,2-3,7-8,11,16H2,1H3,(H,24,27)(H3,23,26,29)/b25-20+