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

Systemtic Name: 5-(3-bromophenyl)-N-cyclohexyl-N-methyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(3-bromophenyl)-N-cyclohexyl-N-methyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(3-bromophenyl)-N-cyclohexyl-N-methyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(3-bromophenyl)-N-cyclohexyl-N-methyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(3-bromophenyl)-N-cyclohexyl-N-methyl-2-pyrazoline-1-carbothioamide Formula: C17H22BrN3S MolecularWeight: 380.34568

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=S)N2CCC(=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

CN(C1CCCCC1)C(=S)N2CCC(=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H22BrN3S/c1-20(15-8-3-2-4-9-15)17(22)21-11-10-16(19-21)13-6-5-7-14(18)12-13/h5-7,12,15H,2-4,8-11H2,1H3