N-[2-[(E)-2-(4-tert-butylphenyl)-1-cyano-ethenyl]-4-phenyl-1,3-thiazol-5-yl]thiophene-2-carboxamide

Systemtic Name: N-[2-[(E)-2-(4-tert-butylphenyl)-1-cyano-ethenyl]-4-phenyl-1,3-thiazol-5-yl]thiophene-2-carboxamide Openeye Name: N-[2-[(E)-2-(4-tert-butylphenyl)-1-cyano-vinyl]-4-phenyl-thiazol-5-yl]thiophene-2-carboxamide CAS Name: N-[2-[(E)-2-(4-tert-butylphenyl)-1-cyanoethenyl]-4-phenyl-5-thiazolyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[(E)-2-(4-tert-butylphenyl)-1-cyanoethenyl]-4-phenyl-1,3-thiazol-5-yl]thiophene-2-carboxamide Traditional Name: N-[2-[(E)-2-(4-tert-butylphenyl)-1-cyano-vinyl]-4-phenyl-thiazol-5-yl]thiophene-2-carboxamide Formula: C27H23N3OS2 MolecularWeight: 469.62102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=C(C#N)C2=NC(=C(S2)NC(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC(=C(S2)NC(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C27H23N3OS2/c1-27(2,3)21-13-11-18(12-14-21)16-20(17-28)25-29-23(19-8-5-4-6-9-19)26(33-25)30-24(31)22-10-7-15-32-22/h4-16H,1-3H3,(H,30,31)/b20-16+