4-[2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine

Systemtic Name: 4-[2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Openeye Name: 4-[2-[[4-phenyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine CAS Name: 4-[2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]ethyl]pyridine IUPAC Name: 4-[2-[[4-phenyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine Traditional Name: 4-[2-[[4-phenyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]ethyl]pyridine Formula: C20H18N4S2 MolecularWeight: 378.51372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCCC3=CC=NC=C3)CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCCC3=CC=NC=C3)CC4=CC=CS4

InChI

InChI=1S/C20H18N4S2/c1-2-5-17(6-3-1)24-19(15-18-7-4-13-25-18)22-23-20(24)26-14-10-16-8-11-21-12-9-16/h1-9,11-13H,10,14-15H2