4-oxidanylidene-3-pentyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-pentyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]phthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-(4-piperidinosulfonylbenzyl)phthalazine-1-carboxamide Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H32N4O4S/c1-2-3-7-18-30-26(32)23-11-6-5-10-22(23)24(28-30)25(31)27-19-20-12-14-21(15-13-20)35(33,34)29-16-8-4-9-17-29/h5-6,10-15H,2-4,7-9,16-19H2,1H3,(H,27,31)