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

Systemtic Name: methyl 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]-3-chloranyl-4-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]-3-chloro-4-methyl-thiophene-2-carboxylate CAS Name: 5-[[[[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]amino]-oxomethyl]amino]-3-chloro-4-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]-3-chloro-4-methylthiophene-2-carboxylate Traditional Name: 5-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]carbamoylamino]-3-chloro-4-methyl-thiophene-2-carboxylic acid methyl ester Formula: C21H22ClFN4O3S MolecularWeight: 464.940783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1Cl)C(=O)OC)NC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C(C)(C)C

Isomeric SMILES

CC1=C(SC(=C1Cl)C(=O)OC)NC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C(C)(C)C

InChI

InChI=1S/C21H22ClFN4O3S/c1-11-16(22)17(19(28)30-5)31-18(11)25-20(29)24-15-10-14(21(2,3)4)26-27(15)13-8-6-12(23)7-9-13/h6-10H,1-5H3,(H2,24,25,29)