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

Systemtic Name: N-[4-(4-bromophenyl)-5-propyl-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[4-(4-bromophenyl)-5-propyl-thiazol-2-yl]-3-nitro-benzamide CAS Name: N-[4-(4-bromophenyl)-5-propyl-2-thiazolyl]-3-nitrobenzamide IUPAC Name: N-[4-(4-bromophenyl)-5-propyl-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[4-(4-bromophenyl)-5-propyl-thiazol-2-yl]-3-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(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrN3O3S/c1-2-4-16-17(12-7-9-14(20)10-8-12)21-19(27-16)22-18(24)13-5-3-6-15(11-13)23(25)26/h3,5-11H,2,4H2,1H3,(H,21,22,24)