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

Systemtic Name: 5-(3-chlorophenyl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(3-chlorophenyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(3-chlorophenyl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(3-chlorophenyl)-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(3-chlorophenyl)-2-pyrazoline-1-carbothioamide Formula: C10H10ClN3S MolecularWeight: 239.7245

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClN3S/c11-8-3-1-2-7(6-8)9-4-5-14(13-9)10(12)15/h1-3,6H,4-5H2,(H2,12,15)