4-methyl-3-[1-[4-(morpholin-4-ylmethyl)phenyl]phthalazin-6-yl]benzamide

Systemtic Name: 4-methyl-3-[1-[4-(morpholin-4-ylmethyl)phenyl]phthalazin-6-yl]benzamide Openeye Name: 4-methyl-3-[1-[4-(morpholinomethyl)phenyl]phthalazin-6-yl]benzamide CAS Name: 4-methyl-3-[1-[4-(4-morpholinylmethyl)phenyl]-6-phthalazinyl]benzamide IUPAC Name: 4-methyl-3-[1-[4-(morpholin-4-ylmethyl)phenyl]phthalazin-6-yl]benzamide Traditional Name: 4-methyl-3-[1-[4-(morpholinomethyl)phenyl]phthalazin-6-yl]benzamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N)C2=CC3=CN=NC(=C3C=C2)C4=CC=C(C=C4)CN5CCOCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N)C2=CC3=CN=NC(=C3C=C2)C4=CC=C(C=C4)CN5CCOCC5

InChI

InChI=1S/C27H26N4O2/c1-18-2-5-22(27(28)32)15-25(18)21-8-9-24-23(14-21)16-29-30-26(24)20-6-3-19(4-7-20)17-31-10-12-33-13-11-31/h2-9,14-16H,10-13,17H2,1H3,(H2,28,32)