N-cyclobutyl-3-[5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)pyrrol-2-yl]propanamide

Systemtic Name: N-cyclobutyl-3-[5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)pyrrol-2-yl]propanamide Openeye Name: N-cyclobutyl-3-[5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)pyrrol-2-yl]propanamide CAS Name: N-cyclobutyl-3-[5-(4-methoxyphenyl)-1-[4-(methylthio)phenyl]-2-pyrrolyl]propanamide IUPAC Name: N-cyclobutyl-3-[5-(4-methoxyphenyl)-1-(4-methylsulfanylphenyl)pyrrol-2-yl]propanamide Traditional Name: N-cyclobutyl-3-[5-(4-methoxyphenyl)-1-[4-(methylthio)phenyl]pyrrol-2-yl]propionamide Formula: C25H28N2O2S MolecularWeight: 420.56702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)SC)CCC(=O)NC4CCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)SC)CCC(=O)NC4CCC4

InChI

InChI=1S/C25H28N2O2S/c1-29-22-12-6-18(7-13-22)24-16-10-21(11-17-25(28)26-19-4-3-5-19)27(24)20-8-14-23(30-2)15-9-20/h6-10,12-16,19H,3-5,11,17H2,1-2H3,(H,26,28)