1-(1-ethyl-5-methyl-pyrazol-4-yl)-3-[2-(5-methylpyrazol-1-yl)ethanoylamino]thiourea hydrochloride

Systemtic Name: 1-(1-ethyl-5-methyl-pyrazol-4-yl)-3-[2-(5-methylpyrazol-1-yl)ethanoylamino]thiourea hydrochloride Openeye Name: 1-(1-ethyl-5-methyl-pyrazol-4-yl)-3-[[2-(5-methylpyrazol-1-yl)acetyl]amino]thiourea hydrochloride CAS Name: 1-(1-ethyl-5-methyl-4-pyrazolyl)-3-[[2-(5-methyl-1-pyrazolyl)-1-oxoethyl]amino]thiourea hydrochloride IUPAC Name: 1-(1-ethyl-5-methylpyrazol-4-yl)-3-[[2-(5-methylpyrazol-1-yl)acetyl]amino]thiourea hydrochloride Traditional Name: 1-(1-ethyl-5-methyl-pyrazol-4-yl)-3-[[2-(5-methylpyrazol-1-yl)acetyl]amino]thiourea hydrochloride Formula: C13H20ClN7OS MolecularWeight: 357.8622

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=S)NNC(=O)CN2C(=CC=N2)C)C.Cl

Isomeric SMILES

CCN1C(=C(C=N1)NC(=S)NNC(=O)CN2C(=CC=N2)C)C.Cl

InChI

InChI=1S/C13H19N7OS.ClH/c1-4-19-10(3)11(7-15-19)16-13(22)18-17-12(21)8-20-9(2)5-6-14-20;/h5-7H,4,8H2,1-3H3,(H,17,21)(H2,16,18,22);1H