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

Systemtic Name: (5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (5-chloro-2-methylsulfonyl-pyrimidin-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: (5-chloro-2-methylsulfonyl-4-pyrimidinyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (5-chloro-2-methylsulfonylpyrimidin-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (5-chloro-2-mesyl-pyrimidin-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C15H14ClN3O3S MolecularWeight: 351.80796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)N2CCC3=CC=CC=C3C2)Cl

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)N2CCC3=CC=CC=C3C2)Cl

InChI

InChI=1S/C15H14ClN3O3S/c1-23(21,22)15-17-8-12(16)13(18-15)14(20)19-7-6-10-4-2-3-5-11(10)9-19/h2-5,8H,6-7,9H2,1H3