N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(2-methoxy-5-methyl-phenyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(2-methoxy-5-methyl-phenyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(2-methoxy-5-methyl-phenyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(2-methoxy-5-methylphenyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(2-methoxy-5-methylphenyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-esyl-N-(2-methoxy-5-methyl-phenyl)isonipecotamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)N(C2=C(C=CC(=C2)C)OC)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)N(C2=C(C=CC(=C2)C)OC)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H27N3O4S2/c1-4-32(28,29)25-13-11-17(12-14-25)22(27)26(19-15-16(2)9-10-20(19)30-3)23-24-18-7-5-6-8-21(18)31-23/h5-10,15,17H,4,11-14H2,1-3H3