N-(4-cyclopentylsulfonylphenyl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-(4-cyclopentylsulfonylphenyl)-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-(4-cyclopentylsulfonylphenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-(4-cyclopentylsulfonylphenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-(4-cyclopentylsulfonylphenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-(4-cyclopentylsulfonylphenyl)-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCC(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H21N3O4S/c25-20(13-19-17-7-3-4-8-18(17)21(26)24-23-19)22-14-9-11-16(12-10-14)29(27,28)15-5-1-2-6-15/h3-4,7-12,15H,1-2,5-6,13H2,(H,22,25)(H,24,26)