N-(2-methoxyethyl)-2-[6-phenyl-2-(phenylmethylsulfanyl)pyrimidin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-methoxyethyl)-2-[6-phenyl-2-(phenylmethylsulfanyl)pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: 2-(2-benzylsulfanyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(2-methoxyethyl)acetamide CAS Name: N-(2-methoxyethyl)-2-[[6-phenyl-2-(phenylmethylthio)-4-pyrimidinyl]thio]acetamide IUPAC Name: 2-(2-benzylsulfanyl-6-phenylpyrimidin-4-yl)sulfanyl-N-(2-methoxyethyl)acetamide Traditional Name: 2-[[2-(benzylthio)-6-phenyl-pyrimidin-4-yl]thio]-N-(2-methoxyethyl)acetamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CSC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

COCCNC(=O)CSC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2S2/c1-27-13-12-23-20(26)16-28-21-14-19(18-10-6-3-7-11-18)24-22(25-21)29-15-17-8-4-2-5-9-17/h2-11,14H,12-13,15-16H2,1H3,(H,23,26)