1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]piperidine-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]piperidine-4-carboxamide Openeye Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]piperidine-4-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-4-piperidinecarboxamide IUPAC Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]piperidine-4-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]isonipecotamide Formula: C22H23ClN4O6S2 MolecularWeight: 539.02422

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H23ClN4O6S2/c1-33-13-12-26-19-14-17(27(29)30)4-7-20(19)34-22(26)24-21(28)15-8-10-25(11-9-15)35(31,32)18-5-2-16(23)3-6-18/h2-7,14-15H,8-13H2,1H3