(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(7-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C15H14ClN3O2S MolecularWeight: 335.80856

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCC3=C(C2)C=C(C=C3)O)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCC3=C(C2)C=C(C=C3)O)Cl

InChI

InChI=1S/C15H14ClN3O2S/c1-22-15-17-7-12(16)13(18-15)14(21)19-5-4-9-2-3-11(20)6-10(9)8-19/h2-3,6-7,20H,4-5,8H2,1H3