2-[[2-methyl-3-[2-(1,2,4-triazol-1-yl)ethylsulfanyl]phenyl]methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[[2-methyl-3-[2-(1,2,4-triazol-1-yl)ethylsulfanyl]phenyl]methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[[2-methyl-3-[2-(1,2,4-triazol-1-yl)ethylsulfanyl]phenyl]methylsulfanyl]-1H-benzimidazole CAS Name: 2-[[2-methyl-3-[2-(1,2,4-triazol-1-yl)ethylthio]phenyl]methylthio]-1H-benzimidazole IUPAC Name: 2-[[2-methyl-3-[2-(1,2,4-triazol-1-yl)ethylsulfanyl]phenyl]methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[[2-methyl-3-[2-(1,2,4-triazol-1-yl)ethylthio]benzyl]thio]-1H-benzimidazole Formula: C19H19N5S2 MolecularWeight: 381.51766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCN2C=NC=N2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC=C1SCCN2C=NC=N2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H19N5S2/c1-14-15(11-26-19-22-16-6-2-3-7-17(16)23-19)5-4-8-18(14)25-10-9-24-13-20-12-21-24/h2-8,12-13H,9-11H2,1H3,(H,22,23)