3-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-2-(3-bromophenyl)prop-2-enenitrile

Systemtic Name: 3-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-2-(3-bromophenyl)prop-2-enenitrile Openeye Name: 3-[5-(1H-benzimidazol-2-ylsulfanyl)-2-furyl]-2-(3-bromophenyl)prop-2-enenitrile CAS Name: 3-[5-(1H-benzimidazol-2-ylthio)-2-furanyl]-2-(3-bromophenyl)-2-propenenitrile IUPAC Name: 3-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-2-(3-bromophenyl)prop-2-enenitrile Traditional Name: 3-[5-(1H-benzimidazol-2-ylthio)-2-furyl]-2-(3-bromophenyl)acrylonitrile Formula: C20H12BrN3OS MolecularWeight: 422.29778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC3=CC=C(O3)C=C(C#N)C4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC3=CC=C(O3)C=C(C#N)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H12BrN3OS/c21-15-5-3-4-13(10-15)14(12-22)11-16-8-9-19(25-16)26-20-23-17-6-1-2-7-18(17)24-20/h1-11H,(H,23,24)