N-[2,6-di(propan-2-yl)phenyl]-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(2,6-diisopropylphenyl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(2,6-diisopropylphenyl)-2-(4-pyridylmethylthio)nicotinamide Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3

InChI

InChI=1S/C24H27N3OS/c1-16(2)19-7-5-8-20(17(3)4)22(19)27-23(28)21-9-6-12-26-24(21)29-15-18-10-13-25-14-11-18/h5-14,16-17H,15H2,1-4H3,(H,27,28)