N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-1-(4-fluorophenyl)-N-methyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-1-(4-fluorophenyl)-N-methyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C20H22FN5O2S MolecularWeight: 415.484383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C1=NN(C(=N1)C2=CC=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C1=NN(C(=N1)C2=CC=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN5O2S/c1-20(2,3)23-16(27)12-25(4)19(28)17-22-18(15-6-5-11-29-15)26(24-17)14-9-7-13(21)8-10-14/h5-11H,12H2,1-4H3,(H,23,27)