4-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-N-naphthalen-1-yl-phthalazin-1-amine

Systemtic Name: 4-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-N-naphthalen-1-yl-phthalazin-1-amine Openeye Name: 4-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-N-(1-naphthyl)phthalazin-1-amine CAS Name: 4-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-N-(1-naphthalenyl)-1-phthalazinamine IUPAC Name: 4-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-N-naphthalen-1-ylphthalazin-1-amine Traditional Name: [4-(4-methyl-3-piperidinosulfonyl-phenyl)phthalazin-1-yl]-(1-naphthyl)amine Formula: C30H28N4O2S MolecularWeight: 508.63392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC5=CC=CC=C54)S(=O)(=O)N6CCCCC6

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC5=CC=CC=C54)S(=O)(=O)N6CCCCC6

InChI

InChI=1S/C30H28N4O2S/c1-21-16-17-23(20-28(21)37(35,36)34-18-7-2-8-19-34)29-25-13-5-6-14-26(25)30(33-32-29)31-27-15-9-11-22-10-3-4-12-24(22)27/h3-6,9-17,20H,2,7-8,18-19H2,1H3,(H,31,33)