N-[2-(phenylmethylsulfanyl)ethyl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[2-(phenylmethylthio)ethyl]-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetamide Formula: C18H23N3OS2 MolecularWeight: 361.52472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)NCCSCC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)NCCSCC2=CC=CC=C2)C

InChI

InChI=1S/C18H23N3OS2/c1-13-14(2)20-18(21-15(13)3)24-12-17(22)19-9-10-23-11-16-7-5-4-6-8-16/h4-8H,9-12H2,1-3H3,(H,19,22)