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

Systemtic Name: N-[4-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-2-methoxy-phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-2-methoxyphenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-2-methoxyphenyl]pyridine-3-carboxamide Traditional Name: N-[4-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-2-methoxy-phenyl]nicotinamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O3S/c1-13-9-14(2)24-21(23-13)30-12-19(27)25-16-6-7-17(18(10-16)29-3)26-20(28)15-5-4-8-22-11-15/h4-11H,12H2,1-3H3,(H,25,27)(H,26,28)