5-(5,6-dimethoxybenzimidazol-1-yl)-3-(2-phenoxyethoxy)thiophene-2-carbonitrile

Systemtic Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(2-phenoxyethoxy)thiophene-2-carbonitrile Openeye Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(2-phenoxyethoxy)thiophene-2-carbonitrile CAS Name: 5-(5,6-dimethoxy-1-benzimidazolyl)-3-(2-phenoxyethoxy)-2-thiophenecarbonitrile IUPAC Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(2-phenoxyethoxy)thiophene-2-carbonitrile Traditional Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-(2-phenoxyethoxy)thiophene-2-carbonitrile Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN2C3=CC(=C(S3)C#N)OCCOC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN2C3=CC(=C(S3)C#N)OCCOC4=CC=CC=C4)OC

InChI

InChI=1S/C22H19N3O4S/c1-26-18-10-16-17(11-19(18)27-2)25(14-24-16)22-12-20(21(13-23)30-22)29-9-8-28-15-6-4-3-5-7-15/h3-7,10-12,14H,8-9H2,1-2H3