N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-4-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-4-nitro-benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-methoxy-N-methyl-4-nitro-benzenesulfonamide Formula: C16H15N3O5S2 MolecularWeight: 393.4374

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)S(=O)(=O)C3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)S(=O)(=O)C3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C16H15N3O5S2/c1-18(10-16-17-12-5-3-4-6-14(12)25-16)26(22,23)15-8-7-11(19(20)21)9-13(15)24-2/h3-9H,10H2,1-2H3