[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]methyl (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid [2-(4-ethylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid [2-(4-ethylphenyl)thiazol-4-yl]methyl ester Formula: C19H16N2O5S MolecularWeight: 384.40574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O5S/c1-2-13-3-5-14(6-4-13)19-20-15(12-27-19)11-25-18(22)10-8-16-7-9-17(26-16)21(23)24/h3-10,12H,2,11H2,1H3/b10-8+