3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclopropyl-4-(furan-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclopropyl-4-(furan-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclopropyl-4-(2-furylmethyl)-1,2,4-triazole CAS Name: 3-[1-(2-chlorophenyl)ethylthio]-5-cyclopropyl-4-(2-furanylmethyl)-1,2,4-triazole IUPAC Name: 3-[1-(2-chlorophenyl)ethylsulfanyl]-5-cyclopropyl-4-(furan-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[1-(2-chlorophenyl)ethylthio]-5-cyclopropyl-4-(2-furfuryl)-1,2,4-triazole Formula: C18H18ClN3OS MolecularWeight: 359.87302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)SC2=NN=C(N2CC3=CC=CO3)C4CC4

Isomeric SMILES

CC(C1=CC=CC=C1Cl)SC2=NN=C(N2CC3=CC=CO3)C4CC4

InChI

InChI=1S/C18H18ClN3OS/c1-12(15-6-2-3-7-16(15)19)24-18-21-20-17(13-8-9-13)22(18)11-14-5-4-10-23-14/h2-7,10,12-13H,8-9,11H2,1H3