3-chloranyl-2-(imidazol-1-ylmethyl)-1-benzothiophene-6-carbonitrile

Systemtic Name: 3-chloranyl-2-(imidazol-1-ylmethyl)-1-benzothiophene-6-carbonitrile Openeye Name: 3-chloro-2-(imidazol-1-ylmethyl)benzothiophene-6-carbonitrile CAS Name: 3-chloro-2-(1-imidazolylmethyl)-1-benzothiophene-6-carbonitrile IUPAC Name: 3-chloro-2-(imidazol-1-ylmethyl)-1-benzothiophene-6-carbonitrile Traditional Name: 3-chloro-2-(imidazol-1-ylmethyl)benzothiophene-6-carbonitrile Formula: C13H8ClN3S MolecularWeight: 273.74072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)SC(=C2Cl)CN3C=CN=C3

Isomeric SMILES

C1=CC2=C(C=C1C#N)SC(=C2Cl)CN3C=CN=C3

InChI

InChI=1S/C13H8ClN3S/c14-13-10-2-1-9(6-15)5-11(10)18-12(13)7-17-4-3-16-8-17/h1-5,8H,7H2