(Z)-2-cyano-N-(2-ethylphenyl)-3-[1-(4-iodanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide

Systemtic Name: (Z)-2-cyano-N-(2-ethylphenyl)-3-[1-(4-iodanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide Openeye Name: (Z)-2-cyano-N-(2-ethylphenyl)-3-[1-(4-iodo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide CAS Name: (Z)-2-cyano-N-(2-ethylphenyl)-3-[1-(4-iodo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenamide IUPAC Name: (Z)-2-cyano-N-(2-ethylphenyl)-3-[1-(4-iodo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enamide Traditional Name: (Z)-2-cyano-N-(2-ethylphenyl)-3-[1-(4-iodo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]acrylamide Formula: C25H24IN3O MolecularWeight: 509.38203

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C(=CC2=C(N(C(=C2)C)C3=CC(=C(C=C3)I)C)C)C#N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)/C(=C\C2=C(N(C(=C2)C)C3=CC(=C(C=C3)I)C)C)/C#N

InChI

InChI=1S/C25H24IN3O/c1-5-19-8-6-7-9-24(19)28-25(30)21(15-27)14-20-13-17(3)29(18(20)4)22-10-11-23(26)16(2)12-22/h6-14H,5H2,1-4H3,(H,28,30)/b21-14-