4-(2-ethoxyethylsulfonyl)-5-(4-nitrophenyl)-3-[2-(propylamino)ethyl]-1,3-benzothiazol-2-one

Systemtic Name: 4-(2-ethoxyethylsulfonyl)-5-(4-nitrophenyl)-3-[2-(propylamino)ethyl]-1,3-benzothiazol-2-one Openeye Name: 4-(2-ethoxyethylsulfonyl)-5-(4-nitrophenyl)-3-[2-(propylamino)ethyl]-1,3-benzothiazol-2-one CAS Name: 4-(2-ethoxyethylsulfonyl)-5-(4-nitrophenyl)-3-[2-(propylamino)ethyl]-1,3-benzothiazol-2-one IUPAC Name: 4-(2-ethoxyethylsulfonyl)-5-(4-nitrophenyl)-3-[2-(propylamino)ethyl]-1,3-benzothiazol-2-one Traditional Name: 4-(2-ethoxyethylsulfonyl)-5-(4-nitrophenyl)-3-[2-(propylamino)ethyl]-1,3-benzothiazol-2-one Formula: C22H27N3O6S2 MolecularWeight: 493.59628

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCN1C2=C(C=CC(=C2S(=O)(=O)CCOCC)C3=CC=C(C=C3)[N+](=O)[O-])SC1=O

Isomeric SMILES

CCCNCCN1C2=C(C=CC(=C2S(=O)(=O)CCOCC)C3=CC=C(C=C3)[N+](=O)[O-])SC1=O

InChI

InChI=1S/C22H27N3O6S2/c1-3-11-23-12-13-24-20-19(32-22(24)26)10-9-18(16-5-7-17(8-6-16)25(27)28)21(20)33(29,30)15-14-31-4-2/h5-10,23H,3-4,11-15H2,1-2H3