phenyl N-[hexyl-[2-(propan-2-yldiazenyl)propan-2-yl]carbamothioyl]carbamate

Systemtic Name: phenyl N-[hexyl-[2-(propan-2-yldiazenyl)propan-2-yl]carbamothioyl]carbamate Openeye Name: phenyl N-[hexyl-(1-isopropylazo-1-methyl-ethyl)carbamothioyl]carbamate CAS Name: N-[[hexyl(2-propan-2-ylazopropan-2-yl)amino]-sulfanylidenemethyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[hexyl-[2-(propan-2-yldiazenyl)propan-2-yl]carbamothioyl]carbamate Traditional Name: N-[hexyl-(1-isopropylazo-1-methyl-ethyl)thiocarbamoyl]carbamic acid phenyl ester Formula: C20H32N4O2S MolecularWeight: 392.55868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(=S)NC(=O)OC1=CC=CC=C1)C(C)(C)N=NC(C)C

Isomeric SMILES

CCCCCCN(C(=S)NC(=O)OC1=CC=CC=C1)C(C)(C)N=NC(C)C

InChI

InChI=1S/C20H32N4O2S/c1-6-7-8-12-15-24(20(4,5)23-22-16(2)3)18(27)21-19(25)26-17-13-10-9-11-14-17/h9-11,13-14,16H,6-8,12,15H2,1-5H3,(H,21,25,27)