2-methyl-1-(2-methylsulfanylethyl)-5-phenyl-N-(4-phenylphenyl)pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(2-methylsulfanylethyl)-5-phenyl-N-(4-phenylphenyl)pyrrole-3-carboxamide Openeye Name: 2-methyl-1-(2-methylsulfanylethyl)-5-phenyl-N-(4-phenylphenyl)pyrrole-3-carboxamide CAS Name: 2-methyl-1-[2-(methylthio)ethyl]-5-phenyl-N-(4-phenylphenyl)-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(2-methylsulfanylethyl)-5-phenyl-N-(4-phenylphenyl)pyrrole-3-carboxamide Traditional Name: 2-methyl-1-[2-(methylthio)ethyl]-5-phenyl-N-(4-phenylphenyl)pyrrole-3-carboxamide Formula: C27H26N2OS MolecularWeight: 426.57314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCSC)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(N1CCSC)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2OS/c1-20-25(19-26(29(20)17-18-31-2)23-11-7-4-8-12-23)27(30)28-24-15-13-22(14-16-24)21-9-5-3-6-10-21/h3-16,19H,17-18H2,1-2H3,(H,28,30)