1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide Openeye Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)-4-piperidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide Traditional Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-5-nitro-1,3-benzothiazol-2-ylidene)isonipecotamide Formula: C21H22N4O6S2 MolecularWeight: 490.55258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H22N4O6S2/c1-23-18-13-15(25(27)28)3-8-19(18)32-21(23)22-20(26)14-9-11-24(12-10-14)33(29,30)17-6-4-16(31-2)5-7-17/h3-8,13-14H,9-12H2,1-2H3