N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(2-pyrimidylthio)acetamide Formula: C20H19N3OS2 MolecularWeight: 381.51436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C20H19N3OS2/c1-14-4-5-15(2)18(12-14)26-17-8-6-16(7-9-17)23-19(24)13-25-20-21-10-3-11-22-20/h3-12H,13H2,1-2H3,(H,23,24)