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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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