N-[5-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-2-methoxy-phenyl]propanamide

Systemtic Name: N-[5-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-2-methoxy-phenyl]propanamide Openeye Name: N-[5-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-2-methoxy-phenyl]propanamide CAS Name: N-[5-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-2-methoxyphenyl]propanamide IUPAC Name: N-[5-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-2-methoxyphenyl]propanamide Traditional Name: N-[5-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-2-methoxy-phenyl]propionamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)NC(=O)CSC2=NC(=CC(=N2)C)C)OC

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)NC(=O)CSC2=NC(=CC(=N2)C)C)OC

InChI

InChI=1S/C18H22N4O3S/c1-5-16(23)22-14-9-13(6-7-15(14)25-4)21-17(24)10-26-18-19-11(2)8-12(3)20-18/h6-9H,5,10H2,1-4H3,(H,21,24)(H,22,23)