N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(6-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-1-tosyl-nipecotamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)OC)C

InChI

InChI=1S/C22H25N3O4S2/c1-15-6-9-18(10-7-15)31(27,28)25-12-4-5-16(14-25)21(26)23-22-24(2)19-11-8-17(29-3)13-20(19)30-22/h6-11,13,16H,4-5,12,14H2,1-3H3