N-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]amino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-keto-butyl]thiophene-3-carboxamide Formula: C22H25FN4O2S MolecularWeight: 428.522903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCNC(=O)C2=CSC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCNC(=O)C2=CSC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN4O2S/c1-22(2,3)18-13-19(27(26-18)17-8-6-16(23)7-9-17)25-20(28)5-4-11-24-21(29)15-10-12-30-14-15/h6-10,12-14H,4-5,11H2,1-3H3,(H,24,29)(H,25,28)