N-[2-[(4-chloranyl-3-cyano-5-methanoyl-thiophen-2-yl)diazenyl]-5-(dibutylamino)phenyl]ethanamide

Systemtic Name: N-[2-[(4-chloranyl-3-cyano-5-methanoyl-thiophen-2-yl)diazenyl]-5-(dibutylamino)phenyl]ethanamide Openeye Name: N-[2-[(4-chloro-3-cyano-5-formyl-2-thienyl)azo]-5-(dibutylamino)phenyl]acetamide CAS Name: N-[2-[(4-chloro-3-cyano-5-formyl-2-thiophenyl)azo]-5-(dibutylamino)phenyl]acetamide IUPAC Name: N-[2-[(4-chloro-3-cyano-5-formylthiophen-2-yl)diazenyl]-5-(dibutylamino)phenyl]acetamide Traditional Name: N-[2-[(4-chloro-3-cyano-5-formyl-2-thienyl)azo]-5-(dibutylamino)phenyl]acetamide Formula: C22H26ClN5O2S MolecularWeight: 459.99214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC(=C(C=C1)N=NC2=C(C(=C(S2)C=O)Cl)C#N)NC(=O)C

Isomeric SMILES

CCCCN(CCCC)C1=CC(=C(C=C1)N=NC2=C(C(=C(S2)C=O)Cl)C#N)NC(=O)C

InChI

InChI=1S/C22H26ClN5O2S/c1-4-6-10-28(11-7-5-2)16-8-9-18(19(12-16)25-15(3)30)26-27-22-17(13-24)21(23)20(14-29)31-22/h8-9,12,14H,4-7,10-11H2,1-3H3,(H,25,30)