N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylthio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(4-cyanobenzyl)thio]benzamide Formula: C22H16N2O3S MolecularWeight: 388.43904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H16N2O3S/c23-12-15-5-7-16(8-6-15)13-28-21-4-2-1-3-18(21)22(25)24-17-9-10-19-20(11-17)27-14-26-19/h1-11H,13-14H2,(H,24,25)