3-[3-[2-(1-propylimidazol-2-yl)sulfanylethanoyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[2-(1-propylimidazol-2-yl)sulfanylethanoyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-(1-propylimidazol-2-yl)sulfanylacetyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[1-oxo-2-[(1-propyl-2-imidazolyl)thio]ethyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-(1-propylimidazol-2-yl)sulfanylacetyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-[(1-propylimidazol-2-yl)thio]acetyl]indol-1-yl]propionitrile Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC(=O)C2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

CCCN1C=CN=C1SCC(=O)C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C19H20N4OS/c1-2-10-22-12-9-21-19(22)25-14-18(24)16-13-23(11-5-8-20)17-7-4-3-6-15(16)17/h3-4,6-7,9,12-13H,2,5,10-11,14H2,1H3