2-[2-[(2,6-dimethylphenyl)amino]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazol-3-ium-5-yl]-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[2-[(2,6-dimethylphenyl)amino]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazol-3-ium-5-yl]-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[3-allyl-2-(2,6-dimethylanilino)-4-oxo-thiazol-3-ium-5-yl]-N-(2-nitrophenyl)acetamide CAS Name: 2-[2-(2,6-dimethylanilino)-4-oxo-3-prop-2-enyl-5-thiazol-3-iumyl]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[2-(2,6-dimethylanilino)-4-oxo-3-prop-2-enyl-1,3-thiazol-3-ium-5-yl]-N-(2-nitrophenyl)acetamide Traditional Name: 2-[3-allyl-2-(2,6-dimethylanilino)-4-keto-2-thiazolin-3-ium-5-yl]-N-(2-nitrophenyl)acetamide Formula: C22H23N4O4S+ MolecularWeight: 439.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=[N+](C(=O)C(S2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-])CC=C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=[N+](C(=O)C(S2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-])CC=C

InChI

InChI=1S/C22H22N4O4S/c1-4-12-25-21(28)18(31-22(25)24-20-14(2)8-7-9-15(20)3)13-19(27)23-16-10-5-6-11-17(16)26(29)30/h4-11,18H,1,12-13H2,2-3H3,(H,23,27)/p+1