2-[3-[2-(2-chlorophenyl)-2-cyano-ethenyl]-2,5-dimethyl-pyrrol-1-yl]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[3-[2-(2-chlorophenyl)-2-cyano-ethenyl]-2,5-dimethyl-pyrrol-1-yl]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[3-[2-(2-chlorophenyl)-2-cyano-vinyl]-2,5-dimethyl-pyrrol-1-yl]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[3-[2-(2-chlorophenyl)-2-cyanoethenyl]-2,5-dimethyl-1-pyrrolyl]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[3-[2-(2-chlorophenyl)-2-cyanoethenyl]-2,5-dimethylpyrrol-1-yl]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[3-[2-(2-chlorophenyl)-2-cyano-vinyl]-2,5-dimethyl-pyrrol-1-yl]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C30H26ClN3OS MolecularWeight: 512.06494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4)C)C=C(C#N)C5=CC=CC=C5Cl

Isomeric SMILES

CC1=CC(=C(N1C2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4)C)C=C(C#N)C5=CC=CC=C5Cl

InChI

InChI=1S/C30H26ClN3OS/c1-19-16-21(17-22(18-32)24-12-6-8-14-26(24)31)20(2)34(19)30-28(25-13-7-9-15-27(25)36-30)29(35)33-23-10-4-3-5-11-23/h3-6,8,10-12,14,16-17H,7,9,13,15H2,1-2H3,(H,33,35)