N-[2-(tert-butylamino)-2-oxidanylidene-1-thiophen-3-yl-ethyl]-N-(4-tert-butylphenyl)-4-cyano-benzamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-1-thiophen-3-yl-ethyl]-N-(4-tert-butylphenyl)-4-cyano-benzamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-1-(3-thienyl)ethyl]-N-(4-tert-butylphenyl)-4-cyano-benzamide CAS Name: N-[2-(tert-butylamino)-2-oxo-1-(3-thiophenyl)ethyl]-N-(4-tert-butylphenyl)-4-cyanobenzamide IUPAC Name: N-[2-(tert-butylamino)-2-oxo-1-thiophen-3-ylethyl]-N-(4-tert-butylphenyl)-4-cyanobenzamide Traditional Name: N-[2-(tert-butylamino)-2-keto-1-(3-thienyl)ethyl]-N-(4-tert-butylphenyl)-4-cyano-benzamide Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N(C(C2=CSC=C2)C(=O)NC(C)(C)C)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N(C(C2=CSC=C2)C(=O)NC(C)(C)C)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C28H31N3O2S/c1-27(2,3)22-11-13-23(14-12-22)31(26(33)20-9-7-19(17-29)8-10-20)24(21-15-16-34-18-21)25(32)30-28(4,5)6/h7-16,18,24H,1-6H3,(H,30,32)