[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone

Systemtic Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Openeye Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-[(3S)-1-(2-thienylsulfonyl)-3-piperidyl]methanone CAS Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[(3S)-1-thiophen-2-ylsulfonyl-3-piperidinyl]methanone IUPAC Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Traditional Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-[(3S)-1-(2-thienylsulfonyl)-3-piperidyl]methanone Formula: C22H25N3O3S3 MolecularWeight: 475.6472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H25N3O3S3/c26-22(17-7-4-12-25(15-17)31(27,28)20-10-5-13-29-20)24-11-3-6-16(14-24)21-23-18-8-1-2-9-19(18)30-21/h1-2,5,8-10,13,16-17H,3-4,6-7,11-12,14-15H2/t16-,17-/m0/s1