3-(pyridin-2-ylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide

Systemtic Name: 3-(pyridin-2-ylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Openeye Name: 3-(2-pyridylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide CAS Name: 3-(2-pyridinylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide IUPAC Name: 3-(pyridin-2-ylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Traditional Name: 3-(2-pyridylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazole-1-carbothioamide Formula: C12H13N5S MolecularWeight: 259.33012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C(=S)N)CC3=CC=CC=N3

Isomeric SMILES

C1CN=C2C1=C(NN2C(=S)N)CC3=CC=CC=N3

InChI

InChI=1S/C12H13N5S/c13-12(18)17-11-9(4-6-15-11)10(16-17)7-8-3-1-2-5-14-8/h1-3,5,16H,4,6-7H2,(H2,13,18)