2-[4-[5-(azepan-1-yl)thiophen-2-yl]-3-cyano-5,5-dimethyl-furan-2-ylidene]propanedinitrile

Systemtic Name: 2-[4-[5-(azepan-1-yl)thiophen-2-yl]-3-cyano-5,5-dimethyl-furan-2-ylidene]propanedinitrile Openeye Name: 2-[4-[5-(azepan-1-yl)-2-thienyl]-3-cyano-5,5-dimethyl-2-furylidene]propanedinitrile CAS Name: 2-[4-[5-(1-azepanyl)-2-thiophenyl]-3-cyano-5,5-dimethyl-2-furanylidene]propanedinitrile IUPAC Name: 2-[4-[5-(azepan-1-yl)thiophen-2-yl]-3-cyano-5,5-dimethylfuran-2-ylidene]propanedinitrile Traditional Name: 2-[4-[5-(azepan-1-yl)-2-thienyl]-3-cyano-5,5-dimethyl-2-furylidene]malononitrile Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=C(C#N)C#N)O1)C#N)C2=CC=C(S2)N3CCCCCC3)C

Isomeric SMILES

CC1(C(=C(C(=C(C#N)C#N)O1)C#N)C2=CC=C(S2)N3CCCCCC3)C

InChI

InChI=1S/C20H20N4OS/c1-20(2)18(15(13-23)19(25-20)14(11-21)12-22)16-7-8-17(26-16)24-9-5-3-4-6-10-24/h7-8H,3-6,9-10H2,1-2H3