2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[(2S)-5-methylhexan-2-yl]ethanamide

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[(2S)-5-methylhexan-2-yl]ethanamide Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[(1S)-1,4-dimethylpentyl]acetamide CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)-N-[(2S)-5-methylhexan-2-yl]acetamide IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-[(2S)-5-methylhexan-2-yl]acetamide Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)-N-[(1S)-1,4-dimethylpentyl]acetamide Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)CSC1=NC=NC2=C1OC3=CC=CC=C32

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)CSC1=NC=NC2=C1OC3=CC=CC=C32

InChI

InChI=1S/C19H23N3O2S/c1-12(2)8-9-13(3)22-16(23)10-25-19-18-17(20-11-21-19)14-6-4-5-7-15(14)24-18/h4-7,11-13H,8-10H2,1-3H3,(H,22,23)/t13-/m0/s1