7-bromanyl-2-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-bromanyl-2-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-bromo-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-bromo-2-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-bromo-2-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-bromo-2-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C18H17BrN4O3S2 MolecularWeight: 481.38658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC(=O)N4C=C(C=CC4=N3)Br

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC(=O)N4C=C(C=CC4=N3)Br

InChI

InChI=1S/C18H17BrN4O3S2/c19-13-3-5-16-21-14(9-18(24)23(16)11-13)12-27-17-6-4-15(10-20-17)28(25,26)22-7-1-2-8-22/h3-6,9-11H,1-2,7-8,12H2