2-methylsulfanyl-N-[(7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamide

Systemtic Name: 2-methylsulfanyl-N-[(7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamide Openeye Name: 2-methylsulfanyl-N-[(7-pyrimidin-2-yl-2,3-dihydrobenzofuran-2-yl)methyl]acetamide CAS Name: 2-(methylthio)-N-[[7-(2-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]acetamide IUPAC Name: 2-methylsulfanyl-N-[(7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]acetamide Traditional Name: 2-(methylthio)-N-[[7-(2-pyrimidyl)coumaran-2-yl]methyl]acetamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)NCC1CC2=CC=CC(=C2O1)C3=NC=CC=N3

Isomeric SMILES

CSCC(=O)NCC1CC2=CC=CC(=C2O1)C3=NC=CC=N3

InChI

InChI=1S/C16H17N3O2S/c1-22-10-14(20)19-9-12-8-11-4-2-5-13(15(11)21-12)16-17-6-3-7-18-16/h2-7,12H,8-10H2,1H3,(H,19,20)