2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3,4-dimethylphenyl)-3-phenylazanyl-3-sulfanyl-prop-2-en-1-one

Systemtic Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3,4-dimethylphenyl)-3-phenylazanyl-3-sulfanyl-prop-2-en-1-one Openeye Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3,4-dimethylphenyl)-3-sulfanyl-prop-2-en-1-one CAS Name: 3-anilino-2-(4-tert-butyl-1-pyridin-1-iumyl)-1-(3,4-dimethylphenyl)-3-mercapto-2-propen-1-one IUPAC Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3,4-dimethylphenyl)-3-sulfanylprop-2-en-1-one Traditional Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(3,4-dimethylphenyl)-3-mercapto-prop-2-en-1-one Formula: C26H29N2OS+ MolecularWeight: 417.58626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(=C(NC2=CC=CC=C2)S)[N+]3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(=C(NC2=CC=CC=C2)S)[N+]3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C26H28N2OS/c1-18-11-12-20(17-19(18)2)24(29)23(25(30)27-22-9-7-6-8-10-22)28-15-13-21(14-16-28)26(3,4)5/h6-17H,1-5H3,(H-,27,29,30)/p+1