2-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phthalazin-1-one

Systemtic Name: 2-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phthalazin-1-one Openeye Name: 2-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phthalazin-1-one CAS Name: 2-[[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-1-phthalazinone IUPAC Name: 2-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phthalazin-1-one Traditional Name: 2-[(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]phthalazin-1-one Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)CN4C(=O)C5=CC=CC=C5C=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)CN4C(=O)C5=CC=CC=C5C=N4

InChI

InChI=1S/C22H24N4O3S/c27-22-20-8-2-1-6-18(20)15-23-26(22)16-24-11-5-7-17-14-19(9-10-21(17)24)30(28,29)25-12-3-4-13-25/h1-2,6,8-10,14-15H,3-5,7,11-13,16H2