1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(pyridin-3-ylmethyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(pyridin-3-ylmethyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide Openeye Name: 1-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-(3-pyridylmethyl)amino]-N-(4-methoxyphenyl)cyclohexanecarboxamide CAS Name: 1-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-(3-pyridinylmethyl)amino]-N-(4-methoxyphenyl)-1-cyclohexanecarboxamide IUPAC Name: 1-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-(pyridin-3-ylmethyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide Traditional Name: 1-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]-(3-pyridylmethyl)amino]-N-(4-methoxyphenyl)cyclohexanecarboxamide Formula: C28H33N5O3S MolecularWeight: 519.65832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N(CC2=CN=CC=C2)C3(CCCCC3)C(=O)NC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N(CC2=CN=CC=C2)C3(CCCCC3)C(=O)NC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C28H33N5O3S/c1-20-16-21(2)31-27(30-20)37-19-25(34)33(18-22-8-7-15-29-17-22)28(13-5-4-6-14-28)26(35)32-23-9-11-24(36-3)12-10-23/h7-12,15-17H,4-6,13-14,18-19H2,1-3H3,(H,32,35)