propan-2-yl 1-ethyl-4-[[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]carbamothioylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]carbamothioylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]carbamothioylamino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[[[1-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-4-pyrazolyl]amino]-sulfanylidenemethyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[[1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]pyrazol-4-yl]carbamothioylamino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]pyrazol-4-yl]thiocarbamoylamino]pyrazole-3-carboxylic acid isopropyl ester Formula: C20H28N8O2S MolecularWeight: 444.55372

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=S)NC2=CN(N=C2)CC3=C(N(N=C3)CC)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=S)NC2=CN(N=C2)CC3=C(N(N=C3)CC)C

InChI

InChI=1S/C20H28N8O2S/c1-6-26-12-17(18(25-26)19(29)30-13(3)4)24-20(31)23-16-9-21-27(11-16)10-15-8-22-28(7-2)14(15)5/h8-9,11-13H,6-7,10H2,1-5H3,(H2,23,24,31)