N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(4-oxo-3H-phthalazin-1-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(4-oxo-3H-phthalazin-1-yl)methyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(4-oxo-3H-phthalazin-1-yl)methyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(4-keto-3H-phthalazin-1-yl)methyl]-4-pyrrolidinosulfonyl-benzamide Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H20N4O4S/c25-19(21-13-18-16-5-1-2-6-17(16)20(26)23-22-18)14-7-9-15(10-8-14)29(27,28)24-11-3-4-12-24/h1-2,5-10H,3-4,11-13H2,(H,21,25)(H,23,26)