(1S,2R)-1-[[2-(2-methylsulfanylpyrimidin-4-yl)quinazolin-4-yl]amino]-2,3-dihydro-1H-inden-2-ol

Systemtic Name: (1S,2R)-1-[[2-(2-methylsulfanylpyrimidin-4-yl)quinazolin-4-yl]amino]-2,3-dihydro-1H-inden-2-ol Openeye Name: (1S,2R)-1-[[2-(2-methylsulfanylpyrimidin-4-yl)quinazolin-4-yl]amino]indan-2-ol CAS Name: (1S,2R)-1-[[2-[2-(methylthio)-4-pyrimidinyl]-4-quinazolinyl]amino]-2,3-dihydro-1H-inden-2-ol IUPAC Name: (1S,2R)-1-[[2-(2-methylsulfanylpyrimidin-4-yl)quinazolin-4-yl]amino]-2,3-dihydro-1H-inden-2-ol Traditional Name: (1S,2R)-1-[[2-[2-(methylthio)pyrimidin-4-yl]quinazolin-4-yl]amino]indan-2-ol Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=NC3=CC=CC=C3C(=N2)NC4C(CC5=CC=CC=C45)O

Isomeric SMILES

CSC1=NC=CC(=N1)C2=NC3=CC=CC=C3C(=N2)N[C@@H]4[C@@H](CC5=CC=CC=C45)O

InChI

InChI=1S/C22H19N5OS/c1-29-22-23-11-10-17(25-22)21-24-16-9-5-4-8-15(16)20(27-21)26-19-14-7-3-2-6-13(14)12-18(19)28/h2-11,18-19,28H,12H2,1H3,(H,24,26,27)/t18-,19+/m1/s1