4-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-N-(2-methylphenyl)phthalazin-1-amine

Systemtic Name: 4-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-N-(2-methylphenyl)phthalazin-1-amine Openeye Name: 4-(4-methyl-3-morpholinosulfonyl-phenyl)-N-(o-tolyl)phthalazin-1-amine CAS Name: 4-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-N-(2-methylphenyl)-1-phthalazinamine IUPAC Name: 4-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-N-(2-methylphenyl)phthalazin-1-amine Traditional Name: [4-(4-methyl-3-morpholinosulfonyl-phenyl)phthalazin-1-yl]-(o-tolyl)amine Formula: C26H26N4O3S MolecularWeight: 474.57464

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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=CC=C4C)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC=C4C)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C26H26N4O3S/c1-18-7-3-6-10-23(18)27-26-22-9-5-4-8-21(22)25(28-29-26)20-12-11-19(2)24(17-20)34(31,32)30-13-15-33-16-14-30/h3-12,17H,13-16H2,1-2H3,(H,27,29)