N-(1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]-N-(2-pyridylmethyl)piperidine-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(2-pyridinylmethyl)-2-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(5-chlorothiophen-2-yl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]-N-(2-pyridylmethyl)pipecolinamide Formula: C23H21ClN4O3S3 MolecularWeight: 533.08584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(S5)Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C23H21ClN4O3S3/c24-20-11-12-21(33-20)34(30,31)28-14-6-4-9-18(28)22(29)27(15-16-7-3-5-13-25-16)23-26-17-8-1-2-10-19(17)32-23/h1-3,5,7-8,10-13,18H,4,6,9,14-15H2