(2S)-2-methyl-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]butanamide

Systemtic Name: (2S)-2-methyl-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]butanamide Openeye Name: (2S)-2-methyl-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]butanamide CAS Name: (2S)-2-methyl-N-[[(2R)-7-(2-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]butanamide IUPAC Name: (2S)-2-methyl-N-[[(2R)-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]butanamide Traditional Name: (2S)-2-methyl-N-[[(2R)-7-(2-pyrimidyl)coumaran-2-yl]methyl]butyramide Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCC1CC2=CC=CC(=C2O1)C3=NC=CC=N3

Isomeric SMILES

CC[C@H](C)C(=O)NC[C@H]1CC2=CC=CC(=C2O1)C3=NC=CC=N3

InChI

InChI=1S/C18H21N3O2/c1-3-12(2)18(22)21-11-14-10-13-6-4-7-15(16(13)23-14)17-19-8-5-9-20-17/h4-9,12,14H,3,10-11H2,1-2H3,(H,21,22)/t12-,14+/m0/s1