2-(4-bromanyl-2-phenyl-phenyl)-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]-2-prop-2-enylsulfanyl-ethanamide

Systemtic Name: 2-(4-bromanyl-2-phenyl-phenyl)-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]-2-prop-2-enylsulfanyl-ethanamide Openeye Name: 2-allylsulfanyl-2-(4-bromo-2-phenyl-phenyl)-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]acetamide CAS Name: 2-(4-bromo-2-phenylphenyl)-N-[2-(3-methoxy-4-prop-2-ynoxyphenyl)ethyl]-2-(prop-2-enylthio)acetamide IUPAC Name: 2-(4-bromo-2-phenylphenyl)-N-[2-(3-methoxy-4-prop-2-ynoxyphenyl)ethyl]-2-prop-2-enylsulfanylacetamide Traditional Name: 2-(allylthio)-2-(4-bromo-2-phenyl-phenyl)-N-[2-(3-methoxy-4-propargyloxy-phenyl)ethyl]acetamide Formula: C29H28BrNO3S MolecularWeight: 550.50652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNC(=O)C(C2=C(C=C(C=C2)Br)C3=CC=CC=C3)SCC=C)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)CCNC(=O)C(C2=C(C=C(C=C2)Br)C3=CC=CC=C3)SCC=C)OCC#C

InChI

InChI=1S/C29H28BrNO3S/c1-4-17-34-26-14-11-21(19-27(26)33-3)15-16-31-29(32)28(35-18-5-2)24-13-12-23(30)20-25(24)22-9-7-6-8-10-22/h1,5-14,19-20,28H,2,15-18H2,3H3,(H,31,32)