N-(1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]-N-(2-pyrazol-1-ylethyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-N-[2-(1-pyrazolyl)ethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(5-chlorothiophen-2-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]-N-(2-pyrazol-1-ylethyl)isonipecotamide Formula: C22H22ClN5O3S3 MolecularWeight: 536.08978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(S5)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C22H22ClN5O3S3/c23-19-6-7-20(33-19)34(30,31)27-12-8-16(9-13-27)21(29)28(15-14-26-11-3-10-24-26)22-25-17-4-1-2-5-18(17)32-22/h1-7,10-11,16H,8-9,12-15H2