N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-1-carbothioamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-1-carbothioamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-1-carbothioamide CAS Name: N-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-1-pyrazolecarbothioamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-1-carbothioamide Traditional Name: N-[1-(2-chlorobenzyl)pyrazol-4-yl]pyrazole-1-carbothioamide Formula: C14H12ClN5S MolecularWeight: 317.79658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=S)N3C=CC=N3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=S)N3C=CC=N3)Cl

InChI

InChI=1S/C14H12ClN5S/c15-13-5-2-1-4-11(13)9-19-10-12(8-17-19)18-14(21)20-7-3-6-16-20/h1-8,10H,9H2,(H,18,21)