N-[2-(cyclohexen-1-yl)ethyl]-4-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]oxy-benzamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-4-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]oxy-benzamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-4-[3-(p-tolylsulfanyl)pyrazin-2-yl]oxy-benzamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-4-[[3-[(4-methylphenyl)thio]-2-pyrazinyl]oxy]benzamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-4-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]oxybenzamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-4-[3-(p-tolylthio)pyrazin-2-yl]oxy-benzamide Formula: C26H27N3O2S MolecularWeight: 445.57648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=CN=C2OC3=CC=C(C=C3)C(=O)NCCC4=CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=CN=C2OC3=CC=C(C=C3)C(=O)NCCC4=CCCCC4

InChI

InChI=1S/C26H27N3O2S/c1-19-7-13-23(14-8-19)32-26-25(28-17-18-29-26)31-22-11-9-21(10-12-22)24(30)27-16-15-20-5-3-2-4-6-20/h5,7-14,17-18H,2-4,6,15-16H2,1H3,(H,27,30)