N-(4-methoxyphenyl)-7-(2-methylphenoxy)-4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-amine

Systemtic Name: N-(4-methoxyphenyl)-7-(2-methylphenoxy)-4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-amine Openeye Name: N-(4-methoxyphenyl)-7-(2-methylphenoxy)-4-(p-tolyl)-3H-1,5-benzodiazepin-2-amine CAS Name: N-(4-methoxyphenyl)-7-(2-methylphenoxy)-4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-amine IUPAC Name: N-(4-methoxyphenyl)-7-(2-methylphenoxy)-4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-amine Traditional Name: (4-methoxyphenyl)-[7-(2-methylphenoxy)-4-(p-tolyl)-3H-1,5-benzodiazepin-2-yl]amine Formula: C30H27N3O2 MolecularWeight: 461.55428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)OC4=CC=CC=C4C)N=C(C2)NC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)OC4=CC=CC=C4C)N=C(C2)NC5=CC=C(C=C5)OC

InChI

InChI=1S/C30H27N3O2/c1-20-8-10-22(11-9-20)27-19-30(31-23-12-14-24(34-3)15-13-23)33-26-17-16-25(18-28(26)32-27)35-29-7-5-4-6-21(29)2/h4-18H,19H2,1-3H3,(H,31,33)