(E)-3-azanyl-2-[2-[5-phenyl-1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoyl]but-2-enenitrile

Systemtic Name: (E)-3-azanyl-2-[2-[5-phenyl-1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoyl]but-2-enenitrile Openeye Name: (E)-3-amino-2-[2-[1-(2-isopropylphenyl)-5-phenyl-imidazol-2-yl]sulfanylacetyl]but-2-enenitrile CAS Name: (E)-3-amino-2-[1-oxo-2-[[5-phenyl-1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]ethyl]-2-butenenitrile IUPAC Name: (E)-3-amino-2-[2-[5-phenyl-1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetyl]but-2-enenitrile Traditional Name: (E)-3-amino-2-[2-[(1-o-cumenyl-5-phenyl-imidazol-2-yl)thio]acetyl]but-2-enenitrile Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=CN=C2SCC(=O)C(=C(C)N)C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=CN=C2SCC(=O)/C(=C(\C)/N)/C#N)C3=CC=CC=C3

InChI

InChI=1S/C24H24N4OS/c1-16(2)19-11-7-8-12-21(19)28-22(18-9-5-4-6-10-18)14-27-24(28)30-15-23(29)20(13-25)17(3)26/h4-12,14,16H,15,26H2,1-3H3/b20-17+