N-phenethyl-N-(phenylmethyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-phenethyl-N-(phenylmethyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-benzyl-N-phenethyl-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-phenethyl-N-(phenylmethyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-benzyl-N-phenethyl-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-benzyl-N-phenethyl-2-(2-pyrimidylthio)acetamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C21H21N3OS/c25-20(17-26-21-22-13-7-14-23-21)24(16-19-10-5-2-6-11-19)15-12-18-8-3-1-4-9-18/h1-11,13-14H,12,15-17H2