propan-2-yl 1-ethyl-4-(furan-2-ylmethylcarbamothioylamino)pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-(furan-2-ylmethylcarbamothioylamino)pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-(2-furylmethylcarbamothioylamino)pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[(2-furanylmethylamino)-sulfanylidenemethyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-(furan-2-ylmethylcarbamothioylamino)pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-(2-furfurylthiocarbamoylamino)pyrazole-3-carboxylic acid isopropyl ester Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=S)NCC2=CC=CO2

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=S)NCC2=CC=CO2

InChI

InChI=1S/C15H20N4O3S/c1-4-19-9-12(13(18-19)14(20)22-10(2)3)17-15(23)16-8-11-6-5-7-21-11/h5-7,9-10H,4,8H2,1-3H3,(H2,16,17,23)