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

Systemtic Name: N-[4-chloranyl-5-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-propyl-benzenesulfonamide Openeye Name: N-[4-chloro-5-(3-nitrophenyl)thiazol-2-yl]-4-propyl-benzenesulfonamide CAS Name: N-[4-chloro-5-(3-nitrophenyl)-2-thiazolyl]-4-propylbenzenesulfonamide IUPAC Name: N-[4-chloro-5-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-propylbenzenesulfonamide Traditional Name: N-[4-chloro-5-(3-nitrophenyl)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(=C(S2)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=C(S2)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16ClN3O4S2/c1-2-4-12-7-9-15(10-8-12)28(25,26)21-18-20-17(19)16(27-18)13-5-3-6-14(11-13)22(23)24/h3,5-11H,2,4H2,1H3,(H,20,21)