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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(S5)Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(S5)Cl

InChI

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