N-[(3-methylphenyl)methyl]-4-(3-phenylsulfanylpyrazin-2-yl)oxy-benzamide

Systemtic Name: N-[(3-methylphenyl)methyl]-4-(3-phenylsulfanylpyrazin-2-yl)oxy-benzamide Openeye Name: N-(m-tolylmethyl)-4-(3-phenylsulfanylpyrazin-2-yl)oxy-benzamide CAS Name: N-[(3-methylphenyl)methyl]-4-[[3-(phenylthio)-2-pyrazinyl]oxy]benzamide IUPAC Name: N-[(3-methylphenyl)methyl]-4-(3-phenylsulfanylpyrazin-2-yl)oxybenzamide Traditional Name: N-(3-methylbenzyl)-4-[3-(phenylthio)pyrazin-2-yl]oxy-benzamide Formula: C25H21N3O2S MolecularWeight: 427.51814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CC=C(C=C2)OC3=NC=CN=C3SC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CC=C(C=C2)OC3=NC=CN=C3SC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2S/c1-18-6-5-7-19(16-18)17-28-23(29)20-10-12-21(13-11-20)30-24-25(27-15-14-26-24)31-22-8-3-2-4-9-22/h2-16H,17H2,1H3,(H,28,29)