5-(3,4-dichlorophenyl)-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(3,4-dichlorophenyl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(3,4-dichlorophenyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(3,4-dichlorophenyl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(3,4-dichlorophenyl)-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(3,4-dichlorophenyl)-2-pyrazoline-1-carbothioamide Formula: C10H9Cl2N3S MolecularWeight: 274.16956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC(=C(C=C2)Cl)Cl)C(=S)N

Isomeric SMILES

C1CN(N=C1C2=CC(=C(C=C2)Cl)Cl)C(=S)N

InChI

InChI=1S/C10H9Cl2N3S/c11-7-2-1-6(5-8(7)12)9-3-4-15(14-9)10(13)16/h1-2,5H,3-4H2,(H2,13,16)