5-[1-(butan-2-ylcarbamoyl)piperidin-3-yl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[1-(butan-2-ylcarbamoyl)piperidin-3-yl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(o-tolyl)-5-[1-(sec-butylcarbamoyl)-3-piperidyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[1-[(butan-2-ylamino)-oxomethyl]-3-piperidinyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[1-(butan-2-ylcarbamoyl)piperidin-3-yl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(o-tolyl)-5-[1-(sec-butylcarbamoyl)-3-piperidyl]-1,3,4-thiadiazole-2-carboxamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)N1CCCC(C1)C2=NN=C(S2)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCC(C)NC(=O)N1CCCC(C1)C2=NN=C(S2)C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C20H27N5O2S/c1-4-14(3)21-20(27)25-11-7-9-15(12-25)18-23-24-19(28-18)17(26)22-16-10-6-5-8-13(16)2/h5-6,8,10,14-15H,4,7,9,11-12H2,1-3H3,(H,21,27)(H,22,26)