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

Systemtic Name: 5-[4-(butylcarbamoyl)piperidin-1-yl]carbonyl-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[4-(butylcarbamoyl)piperidine-1-carbonyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[4-[butylamino(oxo)methyl]-1-piperidinyl]-oxomethyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[4-(butylcarbamoyl)piperidine-1-carbonyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[4-(butylcarbamoyl)piperidine-1-carbonyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C20H24ClN5O3S MolecularWeight: 449.95426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN5O3S/c1-2-3-9-22-16(27)13-7-10-26(11-8-13)20(29)19-25-24-18(30-19)17(28)23-15-6-4-5-14(21)12-15/h4-6,12-13H,2-3,7-11H2,1H3,(H,22,27)(H,23,28)