N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-[2-(3-ethoxy-4-oxidanyl-phenyl)ethanoyl]piperidin-4-yl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-[2-(3-ethoxy-4-oxidanyl-phenyl)ethanoyl]piperidin-4-yl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-[2-(3-ethoxy-4-hydroxy-phenyl)acetyl]-4-piperidyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-[2-(3-ethoxy-4-hydroxyphenyl)-1-oxoethyl]-4-piperidinyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-[2-(3-ethoxy-4-hydroxyphenyl)acetyl]piperidin-4-yl]-6-methylpyridine-3-carboxamide Traditional Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-[2-(3-ethoxy-4-hydroxy-phenyl)acetyl]-4-piperidyl]-6-methyl-nicotinamide Formula: C28H35N5O4S MolecularWeight: 537.6736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NC4=NN=C(S4)C(C)(C)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NC4=NN=C(S4)C(C)(C)C)O

InChI

InChI=1S/C28H35N5O4S/c1-6-37-22-15-18(8-10-21(22)34)16-23(35)33-13-11-19(12-14-33)24-20(9-7-17(2)29-24)25(36)30-27-32-31-26(38-27)28(3,4)5/h7-10,15,19,34H,6,11-14,16H2,1-5H3,(H,30,32,36)