3-[1-(4-tert-butylphenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-[1-(4-tert-butylphenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[1-(4-tert-butylphenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[1-(4-tert-butylphenyl)-6-phthalazinyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[1-(4-tert-butylphenyl)phthalazin-6-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[1-(4-tert-butylphenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=CN=NC(=C4C=C3)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=CN=NC(=C4C=C3)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C29H29N3O/c1-18-5-6-21(28(33)31-24-12-13-24)16-26(18)20-9-14-25-22(15-20)17-30-32-27(25)19-7-10-23(11-8-19)29(2,3)4/h5-11,14-17,24H,12-13H2,1-4H3,(H,31,33)