2H-chromene; (2Z)-2-chromen-2-ylidene-2-methylsulfanyl-ethanenitrile

Systemtic Name: 2H-chromene; (2Z)-2-chromen-2-ylidene-2-methylsulfanyl-ethanenitrile Openeye Name: 2H-chromene; (2Z)-2-chromen-2-ylidene-2-methylsulfanyl-acetonitrile CAS Name: 2H-1-benzopyran; (2Z)-2-(1-benzopyran-2-ylidene)-2-(methylthio)acetonitrile IUPAC Name: 2H-chromene; (2Z)-2-chromen-2-ylidene-2-methylsulfanylacetonitrile Traditional Name: 2H-chromene; (2Z)-2-chromen-2-ylidene-2-(methylthio)acetonitrile Formula: C30H25NO3S MolecularWeight: 479.5894

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C1C=CC2=CC=CC=C2O1)C#N.C1C=CC2=CC=CC=C2O1.C1C=CC2=CC=CC=C2O1

Isomeric SMILES

CS/C(=C\1/C=CC2=CC=CC=C2O1)/C#N.C1C=CC2=CC=CC=C2O1.C1C=CC2=CC=CC=C2O1

InChI

InChI=1S/C12H9NOS.2C9H8O/c1-15-12(8-13)11-7-6-9-4-2-3-5-10(9)14-11;2*1-2-6-9-8(4-1)5-3-7-10-9/h2-7H,1H3;2*1-6H,7H2/b12-11-;;