3-(2-chloranyl-1-benzothiophen-3-yl)-5-(2-ethoxyethylsulfanyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(2-chloranyl-1-benzothiophen-3-yl)-5-(2-ethoxyethylsulfanyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-chlorobenzothiophen-3-yl)-5-(2-ethoxyethylsulfanyl)-4-phenyl-1,2,4-triazole CAS Name: 3-(2-chloro-1-benzothiophen-3-yl)-5-(2-ethoxyethylthio)-4-phenyl-1,2,4-triazole IUPAC Name: 3-(2-chloro-1-benzothiophen-3-yl)-5-(2-ethoxyethylsulfanyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(2-chlorobenzothiophen-3-yl)-5-(2-ethoxyethylthio)-4-phenyl-1,2,4-triazole Formula: C20H18ClN3OS2 MolecularWeight: 415.95942

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NN=C(N1C2=CC=CC=C2)C3=C(SC4=CC=CC=C43)Cl

Isomeric SMILES

CCOCCSC1=NN=C(N1C2=CC=CC=C2)C3=C(SC4=CC=CC=C43)Cl

InChI

InChI=1S/C20H18ClN3OS2/c1-2-25-12-13-26-20-23-22-19(24(20)14-8-4-3-5-9-14)17-15-10-6-7-11-16(15)27-18(17)21/h3-11H,2,12-13H2,1H3