4-(1H-pyrazol-4-yl)butyl carbamimidothioate

Systemtic Name: 4-(1H-pyrazol-4-yl)butyl carbamimidothioate Openeye Name: 2-[4-(1H-pyrazol-4-yl)butyl]isothiourea CAS Name: carbamimidothioic acid 4-(1H-pyrazol-4-yl)butyl ester IUPAC Name: 4-(1H-pyrazol-4-yl)butyl carbamimidothioate Traditional Name: 2-[4-(1H-pyrazol-4-yl)butyl]isothiourea Formula: C8H14N4S MolecularWeight: 198.28856

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1)CCCCSC(=N)N

Isomeric SMILES

C1=C(C=NN1)CCCCSC(=N)N

InChI

InChI=1S/C8H14N4S/c9-8(10)13-4-2-1-3-7-5-11-12-6-7/h5-6H,1-4H2,(H3,9,10)(H,11,12)