(Z)-3-[(2,6-dimethylphenyl)amino]-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one

Systemtic Name: (Z)-3-[(2,6-dimethylphenyl)amino]-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one Openeye Name: (Z)-3-(2,6-dimethylanilino)-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one CAS Name: (Z)-3-(2,6-dimethylanilino)-3-mercapto-1-phenyl-2-(1-pyridin-1-iumyl)-2-propen-1-one IUPAC Name: (Z)-3-(2,6-dimethylanilino)-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanylprop-2-en-1-one Traditional Name: (Z)-3-(2,6-dimethylanilino)-3-mercapto-1-phenyl-2-pyridin-1-ium-1-yl-prop-2-en-1-one Formula: C22H21N2OS+ MolecularWeight: 361.47994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2OS/c1-16-10-9-11-17(2)19(16)23-22(26)20(24-14-7-4-8-15-24)21(25)18-12-5-3-6-13-18/h3-15H,1-2H3,(H-,23,25,26)/p+1