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

Systemtic Name: 2-chloranyl-N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-5-nitro-benzamide Openeye Name: 2-chloro-5-nitro-N-[5-phenyl-4-(p-tolyl)thiazol-2-yl]benzamide CAS Name: 2-chloro-N-[4-(4-methylphenyl)-5-phenyl-2-thiazolyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-5-nitrobenzamide Traditional Name: 2-chloro-5-nitro-N-[5-phenyl-4-(p-tolyl)thiazol-2-yl]benzamide Formula: C23H16ClN3O3S MolecularWeight: 449.90944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H16ClN3O3S/c1-14-7-9-15(10-8-14)20-21(16-5-3-2-4-6-16)31-23(25-20)26-22(28)18-13-17(27(29)30)11-12-19(18)24/h2-13H,1H3,(H,25,26,28)