1-[5-[(5-tert-butyl-3-cyano-2-methoxy-phenyl)carbonylamino]-2-methyl-pyridin-3-yl]-N-(pyridin-3-ylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[5-[(5-tert-butyl-3-cyano-2-methoxy-phenyl)carbonylamino]-2-methyl-pyridin-3-yl]-N-(pyridin-3-ylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[5-[(5-tert-butyl-3-cyano-2-methoxy-benzoyl)amino]-2-methyl-3-pyridyl]-N-(3-pyridylmethyl)triazole-4-carboxamide CAS Name: 1-[5-[[(5-tert-butyl-3-cyano-2-methoxyphenyl)-oxomethyl]amino]-2-methyl-3-pyridinyl]-N-(3-pyridinylmethyl)-4-triazolecarboxamide IUPAC Name: 1-[5-[(5-tert-butyl-3-cyano-2-methoxybenzoyl)amino]-2-methylpyridin-3-yl]-N-(pyridin-3-ylmethyl)triazole-4-carboxamide Traditional Name: 1-[5-[(5-tert-butyl-3-cyano-2-methoxy-benzoyl)amino]-2-methyl-3-pyridyl]-N-(3-pyridylmethyl)triazole-4-carboxamide Formula: C28H28N8O3 MolecularWeight: 524.57372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1N2C=C(N=N2)C(=O)NCC3=CN=CC=C3)NC(=O)C4=C(C(=CC(=C4)C(C)(C)C)C#N)OC

Isomeric SMILES

CC1=NC=C(C=C1N2C=C(N=N2)C(=O)NCC3=CN=CC=C3)NC(=O)C4=C(C(=CC(=C4)C(C)(C)C)C#N)OC

InChI

InChI=1S/C28H28N8O3/c1-17-24(36-16-23(34-35-36)27(38)32-14-18-7-6-8-30-13-18)11-21(15-31-17)33-26(37)22-10-20(28(2,3)4)9-19(12-29)25(22)39-5/h6-11,13,15-16H,14H2,1-5H3,(H,32,38)(H,33,37)