5-(3-bromophenyl)-N-cyclooctyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(3-bromophenyl)-N-cyclooctyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(3-bromophenyl)-N-cyclooctyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(3-bromophenyl)-N-cyclooctyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(3-bromophenyl)-N-cyclooctyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(3-bromophenyl)-N-cyclooctyl-2-pyrazoline-1-carbothioamide Formula: C18H24BrN3S MolecularWeight: 394.37226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=S)N2CCC(=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CCCC(CCC1)NC(=S)N2CCC(=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H24BrN3S/c19-15-8-6-7-14(13-15)17-11-12-22(21-17)18(23)20-16-9-4-2-1-3-5-10-16/h6-8,13,16H,1-5,9-12H2,(H,20,23)