2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 2-[[1-(4-bromophenyl)imidazol-2-yl]thio]-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C19H17BrN4O3S MolecularWeight: 461.33228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C(C)SC2=NC=CN2C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C(C)SC2=NC=CN2C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN4O3S/c1-12-16(4-3-5-17(12)24(26)27)22-18(25)13(2)28-19-21-10-11-23(19)15-8-6-14(20)7-9-15/h3-11,13H,1-2H3,(H,22,25)