3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[(3-chlorobenzothiophen-2-yl)methylsulfanyl]-4-cyclopropyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[(3-chloro-1-benzothiophen-2-yl)methylthio]-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[(3-chloro-1-benzothiophen-2-yl)methylsulfanyl]-4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-[(3-chlorobenzothiophen-2-yl)methylthio]-4-cyclopropyl-5-(2-thienyl)-1,2,4-triazole Formula: C18H14ClN3S3 MolecularWeight: 403.97186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=C(C4=CC=CC=C4S3)Cl)C5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=C(C4=CC=CC=C4S3)Cl)C5=CC=CS5

InChI

InChI=1S/C18H14ClN3S3/c19-16-12-4-1-2-5-13(12)25-15(16)10-24-18-21-20-17(14-6-3-9-23-14)22(18)11-7-8-11/h1-6,9,11H,7-8,10H2