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

Systemtic Name: N-[4-(4-bromophenyl)-5-propyl-1,3-thiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[4-(4-bromophenyl)-5-propyl-thiazol-2-yl]-4-nitro-benzamide CAS Name: N-[4-(4-bromophenyl)-5-propyl-2-thiazolyl]-4-nitrobenzamide IUPAC Name: N-[4-(4-bromophenyl)-5-propyl-1,3-thiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[4-(4-bromophenyl)-5-propyl-thiazol-2-yl]-4-nitro-benzamide Formula: C19H16BrN3O3S MolecularWeight: 446.31764

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Br

Isomeric SMILES

CCCC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrN3O3S/c1-2-3-16-17(12-4-8-14(20)9-5-12)21-19(27-16)22-18(24)13-6-10-15(11-7-13)23(25)26/h4-11H,2-3H2,1H3,(H,21,22,24)