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

Systemtic Name: N-[4-(2-chloranyl-5-nitro-phenyl)-1,3-thiazol-2-yl]-4-propyl-benzenesulfonamide Openeye Name: N-[4-(2-chloro-5-nitro-phenyl)thiazol-2-yl]-4-propyl-benzenesulfonamide CAS Name: N-[4-(2-chloro-5-nitrophenyl)-2-thiazolyl]-4-propylbenzenesulfonamide IUPAC Name: N-[4-(2-chloro-5-nitrophenyl)-1,3-thiazol-2-yl]-4-propylbenzenesulfonamide Traditional Name: N-[4-(2-chloro-5-nitro-phenyl)thiazol-2-yl]-4-propyl-benzenesulfonamide Formula: C18H16ClN3O4S2 MolecularWeight: 437.92034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16ClN3O4S2/c1-2-3-12-4-7-14(8-5-12)28(25,26)21-18-20-17(11-27-18)15-10-13(22(23)24)6-9-16(15)19/h4-11H,2-3H2,1H3,(H,20,21)