N-[4-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[4-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide Openeye Name: N-[4-[(E)-2-(4-methoxyphenyl)vinyl]phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide CAS Name: N-[4-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-3-[(2-pyrazinylthio)methyl]benzamide IUPAC Name: N-[4-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide Traditional Name: N-[4-[(E)-2-(4-methoxyphenyl)vinyl]phenyl]-3-[(pyrazin-2-ylthio)methyl]benzamide Formula: C27H23N3O2S MolecularWeight: 453.55542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)CSC4=NC=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)CSC4=NC=CN=C4

InChI

InChI=1S/C27H23N3O2S/c1-32-25-13-9-21(10-14-25)6-5-20-7-11-24(12-8-20)30-27(31)23-4-2-3-22(17-23)19-33-26-18-28-15-16-29-26/h2-18H,19H2,1H3,(H,30,31)/b6-5+