2-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-acetamide CAS Name: 2-[[4-(4-methoxyphenyl)-6-methyl-2-pyrimidinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(4-methoxyphenyl)-6-methylpyrimidin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl]thio]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=C(C=C2)OC)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=C(C=C2)OC)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-15-12-19(17-8-10-18(26-2)11-9-17)24-21(23-15)27-14-20(25)22-13-16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,22,25)