N-[2,2-bis(phenylsulfanyl)ethenyl]-2-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

Systemtic Name: N-[2,2-bis(phenylsulfanyl)ethenyl]-2-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Openeye Name: N-[2,2-bis(phenylsulfanyl)vinyl]-2-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide CAS Name: N-[2,2-bis(phenylthio)ethenyl]-2-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide IUPAC Name: N-[2,2-bis(phenylsulfanyl)ethenyl]-2-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Traditional Name: N-[2,2-bis(phenylthio)vinyl]-2-bromo-N-homoveratryl-benzamide Formula: C31H28BrNO3S2 MolecularWeight: 606.59292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(C=C(SC2=CC=CC=C2)SC3=CC=CC=C3)C(=O)C4=CC=CC=C4Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(C=C(SC2=CC=CC=C2)SC3=CC=CC=C3)C(=O)C4=CC=CC=C4Br)OC

InChI

InChI=1S/C31H28BrNO3S2/c1-35-28-18-17-23(21-29(28)36-2)19-20-33(31(34)26-15-9-10-16-27(26)32)22-30(37-24-11-5-3-6-12-24)38-25-13-7-4-8-14-25/h3-18,21-22H,19-20H2,1-2H3