5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(3-methylbenzotriazol-5-yl)methoxy]thiophene-2-carbonitrile

Systemtic Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(3-methylbenzotriazol-5-yl)methoxy]thiophene-2-carbonitrile Openeye Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(3-methylbenzotriazol-5-yl)methoxy]thiophene-2-carbonitrile CAS Name: 5-(5,6-dimethoxy-1-benzimidazolyl)-3-[(3-methyl-5-benzotriazolyl)methoxy]-2-thiophenecarbonitrile IUPAC Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(3-methylbenzotriazol-5-yl)methoxy]thiophene-2-carbonitrile Traditional Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(3-methylbenzotriazol-5-yl)methoxy]thiophene-2-carbonitrile Formula: C22H18N6O3S MolecularWeight: 446.48172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)COC3=C(SC(=C3)N4C=NC5=CC(=C(C=C54)OC)OC)C#N)N=N1

Isomeric SMILES

CN1C2=C(C=CC(=C2)COC3=C(SC(=C3)N4C=NC5=CC(=C(C=C54)OC)OC)C#N)N=N1

InChI

InChI=1S/C22H18N6O3S/c1-27-16-6-13(4-5-14(16)25-26-27)11-31-20-9-22(32-21(20)10-23)28-12-24-15-7-18(29-2)19(30-3)8-17(15)28/h4-9,12H,11H2,1-3H3