2-[6-chloranyl-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazol-1-yl]ethanol

Systemtic Name: 2-[6-chloranyl-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazol-1-yl]ethanol Openeye Name: 2-[6-chloro-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazol-1-yl]ethanol CAS Name: 2-[6-chloro-2-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1-benzimidazolyl]ethanol IUPAC Name: 2-[6-chloro-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazol-1-yl]ethanol Traditional Name: 2-[6-chloro-2-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]benzimidazol-1-yl]ethanol Formula: C21H20ClN5OS MolecularWeight: 425.9344

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC4=NC5=C(N4CCO)C=C(C=C5)Cl

Isomeric SMILES

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC4=NC5=C(N4CCO)C=C(C=C5)Cl

InChI

InChI=1S/C21H20ClN5OS/c22-15-8-9-17-18(12-15)26(10-11-28)19(23-17)13-29-21-25-24-20(14-6-7-14)27(21)16-4-2-1-3-5-16/h1-5,8-9,12,14,28H,6-7,10-11,13H2