N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H24N4O4S3 MolecularWeight: 492.63466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C21H24N4O4S3/c26-20(15-5-7-25(8-6-15)32(27,28)19-2-1-13-30-19)22-16-3-4-17-18(14-16)31-21(23-17)24-9-11-29-12-10-24/h1-4,13-15H,5-12H2,(H,22,26)