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

Systemtic Name: N-(4-fluorophenyl)-5-[4-(3-methylbutylcarbamoyl)piperidin-1-yl]carbonyl-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-fluorophenyl)-5-[4-(isopentylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-fluorophenyl)-5-[[4-[(3-methylbutylamino)-oxomethyl]-1-piperidinyl]-oxomethyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-fluorophenyl)-5-[4-(3-methylbutylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-fluorophenyl)-5-[4-(isoamylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide Formula: C21H26FN5O3S MolecularWeight: 447.526243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CCN(CC1)C(=O)C2=NN=C(S2)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CCNC(=O)C1CCN(CC1)C(=O)C2=NN=C(S2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN5O3S/c1-13(2)7-10-23-17(28)14-8-11-27(12-9-14)21(30)20-26-25-19(31-20)18(29)24-16-5-3-15(22)4-6-16/h3-6,13-14H,7-12H2,1-2H3,(H,23,28)(H,24,29)