N-butyl-4-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]oxy-benzamide

Systemtic Name: N-butyl-4-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]oxy-benzamide Openeye Name: N-butyl-4-[3-(p-tolylsulfanyl)pyrazin-2-yl]oxy-benzamide CAS Name: N-butyl-4-[[3-[(4-methylphenyl)thio]-2-pyrazinyl]oxy]benzamide IUPAC Name: N-butyl-4-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]oxybenzamide Traditional Name: N-butyl-4-[3-(p-tolylthio)pyrazin-2-yl]oxy-benzamide Formula: C22H23N3O2S MolecularWeight: 393.50192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)OC2=NC=CN=C2SC3=CC=C(C=C3)C

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)OC2=NC=CN=C2SC3=CC=C(C=C3)C

InChI

InChI=1S/C22H23N3O2S/c1-3-4-13-23-20(26)17-7-9-18(10-8-17)27-21-22(25-15-14-24-21)28-19-11-5-16(2)6-12-19/h5-12,14-15H,3-4,13H2,1-2H3,(H,23,26)