2-[4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenyl]benzonitrile CAS Name: 2-[4-[[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]benzonitrile Traditional Name: 2-[4-[[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]phenyl]benzonitrile Formula: C23H18N4S2 MolecularWeight: 414.54582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)C4=CC=CC=C4C#N)C5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)C4=CC=CC=C4C#N)C5=CC=CS5

InChI

InChI=1S/C23H18N4S2/c24-14-18-4-1-2-5-20(18)17-9-7-16(8-10-17)15-29-23-26-25-22(21-6-3-13-28-21)27(23)19-11-12-19/h1-10,13,19H,11-12,15H2