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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H12BrN3O3S/c1-10-7-12(5-6-15(10)21(23)24)16(22)20-17-19-14(9-25-17)11-3-2-4-13(18)8-11/h2-9H,1H3,(H,19,20,22)