2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)ethanamide

Systemtic Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)ethanamide Openeye Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)acetamide CAS Name: 2-[4-(3-methoxyphenyl)-1-piperazinyl]-N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)acetamide IUPAC Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)acetamide Traditional Name: 2-[4-(3-methoxyphenyl)piperazino]-N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)acetamide Formula: C29H31N5O2 MolecularWeight: 481.58874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C(C1C3=CC=CC=C3)NC(=O)CN4CCN(CC4)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C(C1C3=CC=CC=C3)NC(=O)CN4CCN(CC4)C5=CC(=CC=C5)OC

InChI

InChI=1S/C29H31N5O2/c1-21-28(22-9-4-3-5-10-22)29(31-26-14-7-6-13-25(26)30-21)32-27(35)20-33-15-17-34(18-16-33)23-11-8-12-24(19-23)36-2/h3-14,19,28H,15-18,20H2,1-2H3,(H,31,32,35)