N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(phenylmethyl)-1-propanoyl-piperazine-2-carboxamide

Systemtic Name: N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(phenylmethyl)-1-propanoyl-piperazine-2-carboxamide Openeye Name: 4-benzyl-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-1-propanoyl-piperazine-2-carboxamide CAS Name: N-[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]ethyl]-1-(1-oxopropyl)-4-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: 4-benzyl-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-1-propanoylpiperazine-2-carboxamide Traditional Name: 4-benzyl-N-[2-[3-(4-cyanobenzyl)imidazol-4-yl]ethyl]-1-propionyl-piperazine-2-carboxamide Formula: C28H32N6O2 MolecularWeight: 484.59268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

Isomeric SMILES

CCC(=O)N1CCN(CC1C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C28H32N6O2/c1-2-27(35)34-15-14-32(18-23-6-4-3-5-7-23)20-26(34)28(36)31-13-12-25-17-30-21-33(25)19-24-10-8-22(16-29)9-11-24/h3-11,17,21,26H,2,12-15,18-20H2,1H3,(H,31,36)