3-methyl-4-oxidanylidene-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]phthalazine-1-carboxamide Formula: C19H20N4O4S2 MolecularWeight: 432.5165

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C19H20N4O4S2/c1-22-19(25)15-7-3-2-6-14(15)17(21-22)18(24)20-12-13-8-9-16(28-13)29(26,27)23-10-4-5-11-23/h2-3,6-9H,4-5,10-12H2,1H3,(H,20,24)