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

Systemtic Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(1-isoquinolin-3-ylcarbonylpiperidin-4-yl)-6-methyl-pyridine-3-carboxamide Openeye Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-(isoquinoline-3-carbonyl)-4-piperidyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-[3-isoquinolinyl(oxo)methyl]-4-piperidinyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-(isoquinoline-3-carbonyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide Traditional Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-[1-(isoquinoline-3-carbonyl)-4-piperidyl]-6-methyl-nicotinamide Formula: C28H30N6O2S MolecularWeight: 514.6418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NC2=NN=C(S2)C(C)(C)C)C3CCN(CC3)C(=O)C4=CC5=CC=CC=C5C=N4

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NC2=NN=C(S2)C(C)(C)C)C3CCN(CC3)C(=O)C4=CC5=CC=CC=C5C=N4

InChI

InChI=1S/C28H30N6O2S/c1-17-9-10-21(24(35)31-27-33-32-26(37-27)28(2,3)4)23(30-17)18-11-13-34(14-12-18)25(36)22-15-19-7-5-6-8-20(19)16-29-22/h5-10,15-16,18H,11-14H2,1-4H3,(H,31,33,35)