3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide Openeye Name: 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-thiazol-2-yl-prop-2-enamide CAS Name: 3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyano-N-(2-thiazolyl)-2-propenamide IUPAC Name: 3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide Traditional Name: 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-thiazol-2-yl-acrylamide Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NC3=NC=CS3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NC3=NC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O4S/c1-23(2,3)17-5-7-18(8-6-17)31-20-9-4-15(13-19(20)27(29)30)12-16(14-24)21(28)26-22-25-10-11-32-22/h4-13H,1-3H3,(H,25,26,28)