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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)S(=O)(=O)N5CCOCC5

InChI

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