4-chloranyl-N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(5-ethyl-4-phenyl-thiazol-2-yl)-3-nitro-benzamide CAS Name: 4-chloro-N-(5-ethyl-4-phenyl-2-thiazolyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(5-ethyl-4-phenyl-thiazol-2-yl)-3-nitro-benzamide Formula: C18H14ClN3O3S MolecularWeight: 387.84006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCC1=C(N=C(S1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H14ClN3O3S/c1-2-15-16(11-6-4-3-5-7-11)20-18(26-15)21-17(23)12-8-9-13(19)14(10-12)22(24)25/h3-10H,2H2,1H3,(H,20,21,23)