4-[5-[4-[[5-[tert-butyl(diphenyl)silyl]oxy-2-chloranyl-phenyl]methyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[5-[4-[[5-[tert-butyl(diphenyl)silyl]oxy-2-chloranyl-phenyl]methyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]benzenecarbonitrile Openeye Name: 4-[5-[4-[[5-[tert-butyl(diphenyl)silyl]oxy-2-chloro-phenyl]methyl]-3-oxo-piperazine-1-carbonyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]benzonitrile CAS Name: 4-[5-[[4-[[5-[tert-butyl(diphenyl)silyl]oxy-2-chlorophenyl]methyl]-3-oxo-1-piperazinyl]-oxomethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]benzonitrile IUPAC Name: 4-[5-[4-[[5-[tert-butyl(diphenyl)silyl]oxy-2-chlorophenyl]methyl]-3-oxopiperazine-1-carbonyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]benzonitrile Traditional Name: 4-[5-[4-[5-[tert-butyl(diphenyl)silyl]oxy-2-chloro-benzyl]-3-keto-piperazine-1-carbonyl]-6,7-dihydro-5H-pyrrol[1,2-a]imidazol-3-yl]benzonitrile Formula: C41H40ClN5O3Si MolecularWeight: 714.3265

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC3=CC(=C(C=C3)Cl)CN4CCN(CC4=O)C(=O)C5CCC6=NC=C(N56)C7=CC=C(C=C7)C#N

Isomeric SMILES

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC3=CC(=C(C=C3)Cl)CN4CCN(CC4=O)C(=O)C5CCC6=NC=C(N56)C7=CC=C(C=C7)C#N

InChI

InChI=1S/C41H40ClN5O3Si/c1-41(2,3)51(33-10-6-4-7-11-33,34-12-8-5-9-13-34)50-32-18-19-35(42)31(24-32)27-45-22-23-46(28-39(45)48)40(49)36-20-21-38-44-26-37(47(36)38)30-16-14-29(25-43)15-17-30/h4-19,24,26,36H,20-23,27-28H2,1-3H3