N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)-2-(4-phenylpiperazin-1-yl)ethanamide

Systemtic Name: N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)-2-(4-phenylpiperazin-1-yl)ethanamide Openeye Name: N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)-2-(4-phenylpiperazin-1-yl)acetamide CAS Name: N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)-2-(4-phenyl-1-piperazinyl)acetamide IUPAC Name: N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)-2-(4-phenylpiperazin-1-yl)acetamide Traditional Name: N-(2-methyl-3-phenyl-3H-1,5-benzodiazepin-4-yl)-2-(4-phenylpiperazino)acetamide Formula: C28H29N5O MolecularWeight: 451.56276

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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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N5O/c1-21-27(22-10-4-2-5-11-22)28(30-25-15-9-8-14-24(25)29-21)31-26(34)20-32-16-18-33(19-17-32)23-12-6-3-7-13-23/h2-15,27H,16-20H2,1H3,(H,30,31,34)