propan-2-yl 1-ethyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methylcarbamothioylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methylcarbamothioylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methylcarbamothioylamino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[[(1-ethyl-3-methyl-4-pyrazolyl)methylamino]-sulfanylidenemethyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[(1-ethyl-3-methylpyrazol-4-yl)methylcarbamothioylamino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[(1-ethyl-3-methyl-pyrazol-4-yl)methylthiocarbamoylamino]pyrazole-3-carboxylic acid isopropyl ester Formula: C17H26N6O2S MolecularWeight: 378.49234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CNC(=S)NC2=CN(N=C2C(=O)OC(C)C)CC

Isomeric SMILES

CCN1C=C(C(=N1)C)CNC(=S)NC2=CN(N=C2C(=O)OC(C)C)CC

InChI

InChI=1S/C17H26N6O2S/c1-6-22-9-13(12(5)20-22)8-18-17(26)19-14-10-23(7-2)21-15(14)16(24)25-11(3)4/h9-11H,6-8H2,1-5H3,(H2,18,19,26)