2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(4-methyl-1-oxo-phthalazin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(4-methyl-1-oxo-2-phthalazinyl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-methyl-1-oxophthalazin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(1-keto-4-methyl-phthalazin-2-yl)-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H22N4O4S/c1-15-18-9-2-3-10-19(18)21(27)25(23-15)14-20(26)22-16-7-6-8-17(13-16)30(28,29)24-11-4-5-12-24/h2-3,6-10,13H,4-5,11-12,14H2,1H3,(H,22,26)