1-(4-tert-butylphenyl)sulfonyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide CAS Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-4-piperidinecarboxamide IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)piperidine-4-carboxamide Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)isonipecotamide Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N=C3N(C4=CC=CC=C4S3)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N=C3N(C4=CC=CC=C4S3)C

InChI

InChI=1S/C24H29N3O3S2/c1-24(2,3)18-9-11-19(12-10-18)32(29,30)27-15-13-17(14-16-27)22(28)25-23-26(4)20-7-5-6-8-21(20)31-23/h5-12,17H,13-16H2,1-4H3