(E)-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-3-[1-(3-cyano-1-benzothiophen-2-yl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-2-methyl-phenyl)-2-cyano-3-[1-(3-cyano-1-benzothiophen-2-yl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-methyl-phenyl)-2-cyano-3-[1-(3-cyanobenzothiophen-2-yl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide CAS Name: (E)-N-(5-chloro-2-methylphenyl)-2-cyano-3-[1-(3-cyano-1-benzothiophen-2-yl)-2,5-dimethyl-3-pyrrolyl]-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-methylphenyl)-2-cyano-3-[1-(3-cyano-1-benzothiophen-2-yl)-2,5-dimethylpyrrol-3-yl]prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-methyl-phenyl)-2-cyano-3-[1-(3-cyanobenzothiophen-2-yl)-2,5-dimethyl-pyrrol-3-yl]acrylamide Formula: C26H19ClN4OS MolecularWeight: 470.97326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C(=CC2=C(N(C(=C2)C)C3=C(C4=CC=CC=C4S3)C#N)C)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)/C(=C/C2=C(N(C(=C2)C)C3=C(C4=CC=CC=C4S3)C#N)C)/C#N

InChI

InChI=1S/C26H19ClN4OS/c1-15-8-9-20(27)12-23(15)30-25(32)19(13-28)11-18-10-16(2)31(17(18)3)26-22(14-29)21-6-4-5-7-24(21)33-26/h4-12H,1-3H3,(H,30,32)/b19-11+