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1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperidine-4-carboxamide

1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name:1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperidine-4-carboxamide
Openeye Name:1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]piperidine-4-carboxamide
CAS Name:1-[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]-4-piperidinecarboxamide
IUPAC Name:1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]piperidine-4-carboxamide
Traditional Name:1-[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]isonipecotamide
Formula: C21H21N3O2S2
MolecularWeight: 411.54034
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3


Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3


InChI

InChI=1S/C21H21N3O2S2/c22-19(25)15-9-11-24(12-10-15)20(26)16-7-5-14(6-8-16)13-27-21-23-17-3-1-2-4-18(17)28-21/h1-8,15H,9-13H2,(H2,22,25)


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