N-(4-fluorophenyl)-5-[1-(3-methylbutylcarbamoyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-fluorophenyl)-5-[1-(3-methylbutylcarbamoyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-fluorophenyl)-5-[1-(isopentylcarbamoyl)-3-piperidyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-fluorophenyl)-5-[1-[(3-methylbutylamino)-oxomethyl]-3-piperidinyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-fluorophenyl)-5-[1-(3-methylbutylcarbamoyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-fluorophenyl)-5-[1-(isoamylcarbamoyl)-3-piperidyl]-1,3,4-thiadiazole-2-carboxamide Formula: C20H26FN5O2S MolecularWeight: 419.516143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)N1CCCC(C1)C2=NN=C(S2)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CCNC(=O)N1CCCC(C1)C2=NN=C(S2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H26FN5O2S/c1-13(2)9-10-22-20(28)26-11-3-4-14(12-26)18-24-25-19(29-18)17(27)23-16-7-5-15(21)6-8-16/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,22,28)(H,23,27)