4-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(7-ethyl-2-oxo-chromen-4-yl)methylsulfanylmethyl]benzonitrile CAS Name: 4-[[(7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]methyl]benzonitrile IUPAC Name: 4-[(7-ethyl-2-oxochromen-4-yl)methylsulfanylmethyl]benzonitrile Traditional Name: 4-[[(7-ethyl-2-keto-chromen-4-yl)methylthio]methyl]benzonitrile Formula: C20H17NO2S MolecularWeight: 335.41948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H17NO2S/c1-2-14-7-8-18-17(10-20(22)23-19(18)9-14)13-24-12-16-5-3-15(11-21)4-6-16/h3-10H,2,12-13H2,1H3