(E)-3-(4-tert-butylphenyl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-tert-butylphenyl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enamide Openeye Name: (E)-3-(4-tert-butylphenyl)-N-[4-(4-nitrophenyl)thiazol-2-yl]prop-2-enamide CAS Name: (E)-3-(4-tert-butylphenyl)-N-[4-(4-nitrophenyl)-2-thiazolyl]-2-propenamide IUPAC Name: (E)-3-(4-tert-butylphenyl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enamide Traditional Name: (E)-3-(4-tert-butylphenyl)-N-[4-(4-nitrophenyl)thiazol-2-yl]acrylamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O3S/c1-22(2,3)17-9-4-15(5-10-17)6-13-20(26)24-21-23-19(14-29-21)16-7-11-18(12-8-16)25(27)28/h4-14H,1-3H3,(H,23,24,26)/b13-6+