2-[[3,5-bis(oxidanyl)phenyl]methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[[3,5-bis(oxidanyl)phenyl]methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(3,5-dihydroxyphenyl)methyleneamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(3,5-dihydroxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(3,5-dihydroxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(3,5-dihydroxybenzylidene)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)N=CC3=CC(=CC(=C3)O)O)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N=CC3=CC(=CC(=C3)O)O)C#N

InChI

InChI=1S/C16H14N2O2S/c17-8-14-13-3-1-2-4-15(13)21-16(14)18-9-10-5-11(19)7-12(20)6-10/h5-7,9,19-20H,1-4H2