2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(2-bromanyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(2-bromanyl-4-nitro-phenyl)ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(2-bromo-4-nitro-phenyl)acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(2-bromo-4-nitrophenyl)acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(2-bromo-4-nitrophenyl)acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(2-bromo-4-nitro-phenyl)acetamide Formula: C17H14BrN5O3S MolecularWeight: 448.29376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=N2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=N2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)N

InChI

InChI=1S/C17H14BrN5O3S/c18-13-8-12(23(25)26)6-7-14(13)20-16(24)10-27-17-21-15(9-22(17)19)11-4-2-1-3-5-11/h1-9H,10,19H2,(H,20,24)