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

Systemtic Name: 5-(3-bromophenyl)-N,N-dimethyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(3-bromophenyl)-N,N-dimethyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(3-bromophenyl)-N,N-dimethyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(3-bromophenyl)-N,N-dimethyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(3-bromophenyl)-N,N-dimethyl-2-pyrazoline-1-carbothioamide Formula: C12H14BrN3S MolecularWeight: 312.22866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)N1CCC(=N1)C2=CC(=CC=C2)Br

Isomeric SMILES

CN(C)C(=S)N1CCC(=N1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H14BrN3S/c1-15(2)12(17)16-7-6-11(14-16)9-4-3-5-10(13)8-9/h3-5,8H,6-7H2,1-2H3