N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(2-pyrimidylthio)acetamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)NC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C18H23N3OS/c1-4-14-6-8-15(9-7-14)17(13(2)3)21-16(22)12-23-18-19-10-5-11-20-18/h5-11,13,17H,4,12H2,1-3H3,(H,21,22)/t17-/m0/s1