N-cyclopropyl-6-methyl-7-[1-(2-methylphenyl)phthalazin-6-yl]-1,2-benzoxazol-3-amine

Systemtic Name: N-cyclopropyl-6-methyl-7-[1-(2-methylphenyl)phthalazin-6-yl]-1,2-benzoxazol-3-amine Openeye Name: N-cyclopropyl-6-methyl-7-[1-(o-tolyl)phthalazin-6-yl]-1,2-benzoxazol-3-amine CAS Name: N-cyclopropyl-6-methyl-7-[1-(2-methylphenyl)-6-phthalazinyl]-1,2-benzoxazol-3-amine IUPAC Name: N-cyclopropyl-6-methyl-7-[1-(2-methylphenyl)phthalazin-6-yl]-1,2-benzoxazol-3-amine Traditional Name: cyclopropyl-[6-methyl-7-[1-(o-tolyl)phthalazin-6-yl]indoxazen-3-yl]amine Formula: C26H22N4O MolecularWeight: 406.47908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=NO2)NC3CC3)C4=CC5=CN=NC(=C5C=C4)C6=CC=CC=C6C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=NO2)NC3CC3)C4=CC5=CN=NC(=C5C=C4)C6=CC=CC=C6C

InChI

InChI=1S/C26H22N4O/c1-15-5-3-4-6-20(15)24-21-12-8-17(13-18(21)14-27-29-24)23-16(2)7-11-22-25(23)31-30-26(22)28-19-9-10-19/h3-8,11-14,19H,9-10H2,1-2H3,(H,28,30)