4-chloranyl-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3,5-dinitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3,5-dinitro-benzamide Openeye Name: 4-chloro-N-[4-(4-ethylphenyl)thiazol-2-yl]-3,5-dinitro-benzamide CAS Name: 4-chloro-N-[4-(4-ethylphenyl)-2-thiazolyl]-3,5-dinitrobenzamide IUPAC Name: 4-chloro-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3,5-dinitrobenzamide Traditional Name: 4-chloro-N-[4-(4-ethylphenyl)thiazol-2-yl]-3,5-dinitro-benzamide Formula: C18H13ClN4O5S MolecularWeight: 432.83762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN4O5S/c1-2-10-3-5-11(6-4-10)13-9-29-18(20-13)21-17(24)12-7-14(22(25)26)16(19)15(8-12)23(27)28/h3-9H,2H2,1H3,(H,20,21,24)