2-[[5-(2-chloranyl-1-benzothiophen-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[[5-(2-chloranyl-1-benzothiophen-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[[5-(2-chlorobenzothiophen-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(2-thienyl)ethanone CAS Name: 2-[[5-(2-chloro-1-benzothiophen-3-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-thiophen-2-ylethanone IUPAC Name: 2-[[5-(2-chloro-1-benzothiophen-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-ylethanone Traditional Name: 2-[[5-(2-chlorobenzothiophen-3-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-(2-thienyl)ethanone Formula: C22H14ClN3OS3 MolecularWeight: 468.01406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=CS3)C4=C(SC5=CC=CC=C54)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=CS3)C4=C(SC5=CC=CC=C54)Cl

InChI

InChI=1S/C22H14ClN3OS3/c23-20-19(15-9-4-5-10-17(15)30-20)21-24-25-22(26(21)14-7-2-1-3-8-14)29-13-16(27)18-11-6-12-28-18/h1-12H,13H2