1-[3-(4-chloranylpyrazol-1-yl)propanoylamino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-[3-(4-chloranylpyrazol-1-yl)propanoylamino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea Openeye Name: 1-[3-(4-chloropyrazol-1-yl)propanoylamino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea CAS Name: 1-[[3-(4-chloro-1-pyrazolyl)-1-oxopropyl]amino]-3-(1-ethyl-5-methyl-4-pyrazolyl)thiourea IUPAC Name: 1-[3-(4-chloropyrazol-1-yl)propanoylamino]-3-(1-ethyl-5-methylpyrazol-4-yl)thiourea Traditional Name: 1-[3-(4-chloropyrazol-1-yl)propanoylamino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea Formula: C13H18ClN7OS MolecularWeight: 355.84632

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=S)NNC(=O)CCN2C=C(C=N2)Cl)C

Isomeric SMILES

CCN1C(=C(C=N1)NC(=S)NNC(=O)CCN2C=C(C=N2)Cl)C

InChI

InChI=1S/C13H18ClN7OS/c1-3-21-9(2)11(7-16-21)17-13(23)19-18-12(22)4-5-20-8-10(14)6-15-20/h6-8H,3-5H2,1-2H3,(H,18,22)(H2,17,19,23)