(Z)-2-(2-bromanyl-3,4,5-trimethoxy-phenyl)-3-(1-methylpyrrol-2-yl)-3-methylsulfanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-(2-bromanyl-3,4,5-trimethoxy-phenyl)-3-(1-methylpyrrol-2-yl)-3-methylsulfanyl-prop-2-enenitrile Openeye Name: (Z)-2-(2-bromo-3,4,5-trimethoxy-phenyl)-3-(1-methylpyrrol-2-yl)-3-methylsulfanyl-prop-2-enenitrile CAS Name: (Z)-2-(2-bromo-3,4,5-trimethoxyphenyl)-3-(1-methyl-2-pyrrolyl)-3-(methylthio)-2-propenenitrile IUPAC Name: (Z)-2-(2-bromo-3,4,5-trimethoxyphenyl)-3-(1-methylpyrrol-2-yl)-3-methylsulfanylprop-2-enenitrile Traditional Name: (Z)-2-(2-bromo-3,4,5-trimethoxy-phenyl)-3-(1-methylpyrrol-2-yl)-3-(methylthio)acrylonitrile Formula: C18H19BrN2O3S MolecularWeight: 423.32406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=C(C#N)C2=CC(=C(C(=C2Br)OC)OC)OC)SC

Isomeric SMILES

CN1C=CC=C1/C(=C(/C#N)\C2=CC(=C(C(=C2Br)OC)OC)OC)/SC

InChI

InChI=1S/C18H19BrN2O3S/c1-21-8-6-7-13(21)18(25-5)12(10-20)11-9-14(22-2)16(23-3)17(24-4)15(11)19/h6-9H,1-5H3/b18-12+