N-[3-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]phenyl]nicotinamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CN=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CN=CC=C3)C

InChI

InChI=1S/C20H19N5O2S/c1-13-9-14(2)23-20(22-13)28-12-18(26)24-16-6-3-7-17(10-16)25-19(27)15-5-4-8-21-11-15/h3-11H,12H2,1-2H3,(H,24,26)(H,25,27)