methyl N-cyano-N'-[3-(1H-pyrazol-5-ylamino)propyl]carbamimidothioate

Systemtic Name: methyl N-cyano-N'-[3-(1H-pyrazol-5-ylamino)propyl]carbamimidothioate Openeye Name: 1-cyano-2-methyl-3-[3-(1H-pyrazol-5-ylamino)propyl]isothiourea CAS Name: N-cyano-N'-[3-(1H-pyrazol-5-ylamino)propyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N-cyano-N'-[3-(1H-pyrazol-5-ylamino)propyl]carbamimidothioate Traditional Name: 1-cyano-2-methyl-3-[3-(1H-pyrazol-5-ylamino)propyl]isothiourea Formula: C9H14N6S MolecularWeight: 238.31266

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCCNC1=CC=NN1)NC#N

Isomeric SMILES

CSC(=NCCCNC1=CC=NN1)NC#N

InChI

InChI=1S/C9H14N6S/c1-16-9(13-7-10)12-5-2-4-11-8-3-6-14-15-8/h3,6H,2,4-5H2,1H3,(H,12,13)(H2,11,14,15)