5-[3,5-diethyl-2-(2-phenylmethoxyethyl)imidazol-4-yl]sulfanylbenzene-1,3-dicarbonitrile

Systemtic Name: 5-[3,5-diethyl-2-(2-phenylmethoxyethyl)imidazol-4-yl]sulfanylbenzene-1,3-dicarbonitrile Openeye Name: 5-[2-(2-benzyloxyethyl)-3,5-diethyl-imidazol-4-yl]sulfanylbenzene-1,3-dicarbonitrile CAS Name: 5-[[3,5-diethyl-2-(2-phenylmethoxyethyl)-4-imidazolyl]thio]benzene-1,3-dicarbonitrile IUPAC Name: 5-[3,5-diethyl-2-(2-phenylmethoxyethyl)imidazol-4-yl]sulfanylbenzene-1,3-dicarbonitrile Traditional Name: 5-[[2-(2-benzoxyethyl)-3,5-diethyl-imidazol-4-yl]thio]isophthalonitrile Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=N1)CCOCC2=CC=CC=C2)CC)SC3=CC(=CC(=C3)C#N)C#N

Isomeric SMILES

CCC1=C(N(C(=N1)CCOCC2=CC=CC=C2)CC)SC3=CC(=CC(=C3)C#N)C#N

InChI

InChI=1S/C24H24N4OS/c1-3-22-24(30-21-13-19(15-25)12-20(14-21)16-26)28(4-2)23(27-22)10-11-29-17-18-8-6-5-7-9-18/h5-9,12-14H,3-4,10-11,17H2,1-2H3