6-[4-(2-dimethylaminoethyloxy)phenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile

Systemtic Name: 6-[4-(2-dimethylaminoethyloxy)phenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carbonitrile Openeye Name: 6-[4-(2-dimethylaminoethyloxy)phenyl]-4-methylsulfanyl-2-oxo-pyran-3-carbonitrile CAS Name: 6-[4-(2-dimethylaminoethyloxy)phenyl]-4-(methylthio)-2-oxo-3-pyrancarbonitrile IUPAC Name: 6-[4-(2-dimethylaminoethyloxy)phenyl]-4-methylsulfanyl-2-oxopyran-3-carbonitrile Traditional Name: 6-[4-(2-dimethylaminoethyloxy)phenyl]-2-keto-4-(methylthio)pyran-3-carbonitrile Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC=C(C=C1)C2=CC(=C(C(=O)O2)C#N)SC

Isomeric SMILES

CN(C)CCOC1=CC=C(C=C1)C2=CC(=C(C(=O)O2)C#N)SC

InChI

InChI=1S/C17H18N2O3S/c1-19(2)8-9-21-13-6-4-12(5-7-13)15-10-16(23-3)14(11-18)17(20)22-15/h4-7,10H,8-9H2,1-3H3