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1-(3-imidazol-1-ylpropyl)-1-thiophen-2-yl-3H-2-benzofuran-5-carbonitrile hydrochloride

1-(3-imidazol-1-ylpropyl)-1-thiophen-2-yl-3H-2-benzofuran-5-carbonitrile hydrochloride

Systemtic Name:1-(3-imidazol-1-ylpropyl)-1-thiophen-2-yl-3H-2-benzofuran-5-carbonitrile hydrochloride
Openeye Name:1-(3-imidazol-1-ylpropyl)-1-(2-thienyl)-3H-isobenzofuran-5-carbonitrile hydrochloride
CAS Name:1-[3-(1-imidazolyl)propyl]-1-thiophen-2-yl-3H-isobenzofuran-5-carbonitrile hydrochloride
IUPAC Name:1-(3-imidazol-1-ylpropyl)-1-thiophen-2-yl-3H-2-benzofuran-5-carbonitrile hydrochloride
Traditional Name:1-(3-imidazol-1-ylpropyl)-1-(2-thienyl)phthalan-5-carbonitrile hydrochloride
Formula: C19H18ClN3OS
MolecularWeight: 371.88372
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C#N)C(O1)(CCCN3C=CN=C3)C4=CC=CS4.Cl


Isomeric SMILES

C1C2=C(C=CC(=C2)C#N)C(O1)(CCCN3C=CN=C3)C4=CC=CS4.Cl


InChI

InChI=1S/C19H17N3OS.ClH/c20-12-15-4-5-17-16(11-15)13-23-19(17,18-3-1-10-24-18)6-2-8-22-9-7-21-14-22;/h1,3-5,7,9-11,14H,2,6,8,13H2;1H


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