N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(1-hept-2-ynoylpiperidin-4-yl)-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(1-hept-2-ynoylpiperidin-4-yl)-6-methyl-pyridine-3-carboxamide Openeye Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(1-hept-2-ynoyl-4-piperidyl)-6-methyl-pyridine-3-carboxamide CAS Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-6-methyl-2-[1-(1-oxohept-2-ynyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(1-hept-2-ynoylpiperidin-4-yl)-6-methylpyridine-3-carboxamide Traditional Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(1-hept-2-ynoyl-4-piperidyl)-6-methyl-nicotinamide Formula: C25H33N5O2S MolecularWeight: 467.62682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NC3=NN=C(S3)C(C)(C)C

Isomeric SMILES

CCCCC#CC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NC3=NN=C(S3)C(C)(C)C

InChI

InChI=1S/C25H33N5O2S/c1-6-7-8-9-10-20(31)30-15-13-18(14-16-30)21-19(12-11-17(2)26-21)22(32)27-24-29-28-23(33-24)25(3,4)5/h11-12,18H,6-8,13-16H2,1-5H3,(H,27,29,32)