1-ethyl-N-(furan-2-ylmethyl)-4-[3-(phenylsulfonyl)propanoylamino]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-N-(furan-2-ylmethyl)-4-[3-(phenylsulfonyl)propanoylamino]pyrazole-3-carboxamide Openeye Name: 4-[3-(benzenesulfonyl)propanoylamino]-1-ethyl-N-(2-furylmethyl)pyrazole-3-carboxamide CAS Name: 4-[[3-(benzenesulfonyl)-1-oxopropyl]amino]-1-ethyl-N-(2-furanylmethyl)-3-pyrazolecarboxamide IUPAC Name: 4-[3-(benzenesulfonyl)propanoylamino]-1-ethyl-N-(furan-2-ylmethyl)pyrazole-3-carboxamide Traditional Name: 4-(3-besylpropanoylamino)-1-ethyl-N-(2-furfuryl)pyrazole-3-carboxamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O5S/c1-2-24-14-17(19(23-24)20(26)21-13-15-7-6-11-29-15)22-18(25)10-12-30(27,28)16-8-4-3-5-9-16/h3-9,11,14H,2,10,12-13H2,1H3,(H,21,26)(H,22,25)