(2Z)-2-[[[5-(4-tert-butylphenyl)thiophen-2-yl]-methyl-amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile

Systemtic Name: (2Z)-2-[[[5-(4-tert-butylphenyl)thiophen-2-yl]-methyl-amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-2-[[[5-(4-tert-butylphenyl)-2-thienyl]-methyl-amino]-hydroxy-methylene]-3-oxo-butanenitrile CAS Name: (2Z)-2-[[[5-(4-tert-butylphenyl)-2-thiophenyl]-methylamino]-hydroxymethylidene]-3-oxobutanenitrile IUPAC Name: (2Z)-2-[[[5-(4-tert-butylphenyl)thiophen-2-yl]-methylamino]-hydroxymethylidene]-3-oxobutanenitrile Traditional Name: (Z)-2-acetyl-3-[[5-(4-tert-butylphenyl)-2-thienyl]-methyl-amino]-3-hydroxy-acrylonitrile Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(N(C)C1=CC=C(S1)C2=CC=C(C=C2)C(C)(C)C)O)C#N

Isomeric SMILES

CC(=O)/C(=C(/N(C)C1=CC=C(S1)C2=CC=C(C=C2)C(C)(C)C)\O)/C#N

InChI

InChI=1S/C20H22N2O2S/c1-13(23)16(12-21)19(24)22(5)18-11-10-17(25-18)14-6-8-15(9-7-14)20(2,3)4/h6-11,24H,1-5H3/b19-16-