N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-2-nitro-benzamide

Systemtic Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-2-nitro-benzamide Openeye Name: N-[5-[(4-bromophenyl)methyl]thiazol-2-yl]-2-nitro-benzamide CAS Name: N-[5-[(4-bromophenyl)methyl]-2-thiazolyl]-2-nitrobenzamide IUPAC Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-2-nitrobenzamide Traditional Name: N-[5-(4-bromobenzyl)thiazol-2-yl]-2-nitro-benzamide Formula: C17H12BrN3O3S MolecularWeight: 418.26448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrN3O3S/c18-12-7-5-11(6-8-12)9-13-10-19-17(25-13)20-16(22)14-3-1-2-4-15(14)21(23)24/h1-8,10H,9H2,(H,19,20,22)