3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide Openeye Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-[4-(3-nitrophenyl)thiazol-2-yl]propanamide CAS Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-[4-(3-nitrophenyl)-2-thiazolyl]propanamide IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-[4-(3-nitrophenyl)thiazol-2-yl]propionamide Formula: C20H18BrN3O5S MolecularWeight: 492.34302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C20H18BrN3O5S/c1-28-17-9-12(15(21)10-18(17)29-2)6-7-19(25)23-20-22-16(11-30-20)13-4-3-5-14(8-13)24(26)27/h3-5,8-11H,6-7H2,1-2H3,(H,22,23,25)