(NZ)-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzenesulfonamide

Systemtic Name: (NZ)-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzenesulfonamide Openeye Name: (NZ)-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzenesulfonamide CAS Name: (NZ)-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzenesulfonamide IUPAC Name: (NZ)-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzenesulfonamide Traditional Name: (NZ)-N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]benzenesulfonamide Formula: C16H15N3O5S2 MolecularWeight: 393.4374

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COCCN\1C2=C(C=C(C=C2)[N+](=O)[O-])S/C1=N\S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O5S2/c1-24-10-9-18-14-8-7-12(19(20)21)11-15(14)25-16(18)17-26(22,23)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3/b17-16-