2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-N-(4-methoxyphenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-N-(4-methoxyphenyl)-2-phenyl-ethanamide Openeye Name: 2-[benzyl-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N-(4-methoxyphenyl)-2-phenyl-acetamide CAS Name: 2-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]-(phenylmethyl)amino]-N-(4-methoxyphenyl)-2-phenylacetamide IUPAC Name: 2-[benzyl-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N-(4-methoxyphenyl)-2-phenylacetamide Traditional Name: 2-[benzyl-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-N-(4-methoxyphenyl)-2-phenyl-acetamide Formula: C30H30N4O3S MolecularWeight: 526.6492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H30N4O3S/c1-21-18-22(2)32-30(31-21)38-20-27(35)34(19-23-10-6-4-7-11-23)28(24-12-8-5-9-13-24)29(36)33-25-14-16-26(37-3)17-15-25/h4-18,28H,19-20H2,1-3H3,(H,33,36)