methyl 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]thiophene-2-carboxylate CAS Name: 5-[[[[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]amino]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]thiophene-2-carboxylate Traditional Name: 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C20H21FN4O3S MolecularWeight: 416.469143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(S2)C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(S2)C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4O3S/c1-20(2,3)15-11-16(25(24-15)13-7-5-12(21)6-8-13)22-19(27)23-17-10-9-14(29-17)18(26)28-4/h5-11H,1-4H3,(H2,22,23,27)