N-(1,2-benzoxazol-3-ylmethylsulfonyl)-1-[3-cyano-5-(5-ethyl-1,3-oxazol-2-yl)-6-methyl-pyridin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-(1,2-benzoxazol-3-ylmethylsulfonyl)-1-[3-cyano-5-(5-ethyl-1,3-oxazol-2-yl)-6-methyl-pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-(1,2-benzoxazol-3-ylmethylsulfonyl)-1-[3-cyano-5-(5-ethyloxazol-2-yl)-6-methyl-2-pyridyl]piperidine-4-carboxamide CAS Name: N-(1,2-benzoxazol-3-ylmethylsulfonyl)-1-[3-cyano-5-(5-ethyl-2-oxazolyl)-6-methyl-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(1,2-benzoxazol-3-ylmethylsulfonyl)-1-[3-cyano-5-(5-ethyl-1,3-oxazol-2-yl)-6-methylpyridin-2-yl]piperidine-4-carboxamide Traditional Name: 1-[3-cyano-5-(5-ethyloxazol-2-yl)-6-methyl-2-pyridyl]-N-(indoxazen-3-ylmethylsulfonyl)isonipecotamide Formula: C26H26N6O5S MolecularWeight: 534.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(O1)C2=C(N=C(C(=C2)C#N)N3CCC(CC3)C(=O)NS(=O)(=O)CC4=NOC5=CC=CC=C54)C

Isomeric SMILES

CCC1=CN=C(O1)C2=C(N=C(C(=C2)C#N)N3CCC(CC3)C(=O)NS(=O)(=O)CC4=NOC5=CC=CC=C54)C

InChI

InChI=1S/C26H26N6O5S/c1-3-19-14-28-26(36-19)21-12-18(13-27)24(29-16(21)2)32-10-8-17(9-11-32)25(33)31-38(34,35)15-22-20-6-4-5-7-23(20)37-30-22/h4-7,12,14,17H,3,8-11,15H2,1-2H3,(H,31,33)