2-[4-(1H-benzimidazol-2-ylsulfanyl)but-2-ynylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[4-(1H-benzimidazol-2-ylsulfanyl)but-2-ynylsulfanyl]-1H-benzimidazole Openeye Name: 2-[4-(1H-benzimidazol-2-ylsulfanyl)but-2-ynylsulfanyl]-1H-benzimidazole CAS Name: 2-[4-(1H-benzimidazol-2-ylthio)but-2-ynylthio]-1H-benzimidazole IUPAC Name: 2-[4-(1H-benzimidazol-2-ylsulfanyl)but-2-ynylsulfanyl]-1H-benzimidazole Traditional Name: 2-[4-(1H-benzimidazol-2-ylthio)but-2-ynylthio]-1H-benzimidazole Formula: C18H14N4S2 MolecularWeight: 350.46056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC#CCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC#CCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H14N4S2/c1-2-8-14-13(7-1)19-17(20-14)23-11-5-6-12-24-18-21-15-9-3-4-10-16(15)22-18/h1-4,7-10H,11-12H2,(H,19,20)(H,21,22)