N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-esyl-isonipecotamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3O3S2/c1-2-29(26,27)24-13-11-15(12-14-24)20(25)22-17-9-7-16(8-10-17)21-23-18-5-3-4-6-19(18)28-21/h3-10,15H,2,11-14H2,1H3,(H,22,25)