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N-cyclooctyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide

N-cyclooctyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name:N-cyclooctyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide
Openeye Name:N-cyclooctyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide
CAS Name:N-cyclooctyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide
IUPAC Name:N-cyclooctyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide
Traditional Name:N-cyclooctyl-3,5-diphenyl-2-pyrazoline-1-carbothioamide
Formula: C24H29N3S
MolecularWeight: 391.57216
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4


Isomeric SMILES

C1CCCC(CCC1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4


InChI

InChI=1S/C24H29N3S/c28-24(25-21-16-10-2-1-3-11-17-21)27-23(20-14-8-5-9-15-20)18-22(26-27)19-12-6-4-7-13-19/h4-9,12-15,21,23H,1-3,10-11,16-18H2,(H,25,28)


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