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

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

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FN5O2S/c1-4-25(5-2)17(27)13-24(3)20(28)18-22-19(16-10-7-11-29-16)26(23-18)15-9-6-8-14(21)12-15/h6-12H,4-5,13H2,1-3H3