2-cyclohex-3-en-1-yl-2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(pyridin-3-ylmethyl)amino]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-cyclohex-3-en-1-yl-2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(pyridin-3-ylmethyl)amino]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-cyclohex-3-en-1-yl-2-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-(3-pyridylmethyl)amino]-N-(4-methoxyphenyl)acetamide CAS Name: 2-(1-cyclohex-3-enyl)-2-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-(3-pyridinylmethyl)amino]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-cyclohex-3-en-1-yl-2-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]-(pyridin-3-ylmethyl)amino]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-cyclohex-3-en-1-yl-2-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]-(3-pyridylmethyl)amino]-N-(4-methoxyphenyl)acetamide Formula: C29H33N5O3S MolecularWeight: 531.66902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N(CC2=CN=CC=C2)C(C3CCC=CC3)C(=O)NC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N(CC2=CN=CC=C2)C(C3CCC=CC3)C(=O)NC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C29H33N5O3S/c1-20-16-21(2)32-29(31-20)38-19-26(35)34(18-22-8-7-15-30-17-22)27(23-9-5-4-6-10-23)28(36)33-24-11-13-25(37-3)14-12-24/h4-5,7-8,11-17,23,27H,6,9-10,18-19H2,1-3H3,(H,33,36)