2-[4-(2-cyano-4-tritio-phenyl)piperazin-1-yl]-N-(3-methyl-4-tritio-phenyl)ethanamide

Systemtic Name: 2-[4-(2-cyano-4-tritio-phenyl)piperazin-1-yl]-N-(3-methyl-4-tritio-phenyl)ethanamide Openeye Name: 2-[4-(2-cyano-4-tritio-phenyl)piperazin-1-yl]-N-(3-methyl-4-tritio-phenyl)acetamide CAS Name: 2-[4-(2-cyano-4-tritiophenyl)-1-piperazinyl]-N-(3-methyl-4-tritiophenyl)acetamide IUPAC Name: 2-[4-(2-cyano-4-tritiophenyl)piperazin-1-yl]-N-(3-methyl-4-tritiophenyl)acetamide Traditional Name: 2-[4-(2-cyano-4-tritio-phenyl)piperazino]-N-(3-methyl-4-tritio-phenyl)acetamide Formula: C20H22N4O MolecularWeight: 338.431099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3C#N

Isomeric SMILES

[3H]C1=CC=C(C(=C1)C#N)N2CCN(CC2)CC(=O)NC3=CC=C(C(=C3)C)[3H]

InChI

InChI=1S/C20H22N4O/c1-16-5-4-7-18(13-16)22-20(25)15-23-9-11-24(12-10-23)19-8-3-2-6-17(19)14-21/h2-8,13H,9-12,15H2,1H3,(H,22,25)/i2T,5T