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

Systemtic Name: 5-[4-(3-methylbutylcarbamoyl)piperidin-1-yl]carbonyl-N-phenyl-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[4-(isopentylcarbamoyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[4-[(3-methylbutylamino)-oxomethyl]-1-piperidinyl]-oxomethyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[4-(3-methylbutylcarbamoyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[4-(isoamylcarbamoyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide Formula: C21H27N5O3S MolecularWeight: 429.53578

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O3S/c1-14(2)8-11-22-17(27)15-9-12-26(13-10-15)21(29)20-25-24-19(30-20)18(28)23-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3,(H,22,27)(H,23,28)