4-methyl-N-[5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-2-piperidin-1-yl-phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-2-piperidin-1-yl-phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[5-(3-methyl-4-oxo-phthalazin-1-yl)-2-(1-piperidyl)phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[5-(3-methyl-4-oxo-1-phthalazinyl)-2-(1-piperidinyl)phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[5-(3-methyl-4-oxophthalazin-1-yl)-2-piperidin-1-ylphenyl]benzenesulfonamide Traditional Name: N-[5-(4-keto-3-methyl-phthalazin-1-yl)-2-piperidino-phenyl]-4-methyl-benzenesulfonamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C3=NN(C(=O)C4=CC=CC=C43)C)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C3=NN(C(=O)C4=CC=CC=C43)C)N5CCCCC5

InChI

InChI=1S/C27H28N4O3S/c1-19-10-13-21(14-11-19)35(33,34)29-24-18-20(12-15-25(24)31-16-6-3-7-17-31)26-22-8-4-5-9-23(22)27(32)30(2)28-26/h4-5,8-15,18,29H,3,6-7,16-17H2,1-2H3