N-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]-3-nitro-aniline

Systemtic Name: N-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]-3-nitro-aniline Openeye Name: N-[[2-(3-bromophenyl)thiazol-4-yl]methyl]-3-nitro-aniline CAS Name: N-[[2-(3-bromophenyl)-4-thiazolyl]methyl]-3-nitroaniline IUPAC Name: N-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]-3-nitroaniline Traditional Name: [2-(3-bromophenyl)thiazol-4-yl]methyl-(3-nitrophenyl)amine Formula: C16H12BrN3O2S MolecularWeight: 390.25438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NC(=CS2)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NC(=CS2)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrN3O2S/c17-12-4-1-3-11(7-12)16-19-14(10-23-16)9-18-13-5-2-6-15(8-13)20(21)22/h1-8,10,18H,9H2