[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]-[1-(2-thienylsulfonyl)-4-piperidyl]methanone CAS Name: [(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methanone IUPAC Name: [(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [(2R)-2-(1,3-benzothiazol-2-yl)piperidino]-[1-(2-thienylsulfonyl)-4-piperidyl]methanone Formula: C22H25N3O3S3 MolecularWeight: 475.6472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCN([C@H](C1)C2=NC3=CC=CC=C3S2)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H25N3O3S3/c26-22(16-10-13-24(14-11-16)31(27,28)20-9-5-15-29-20)25-12-4-3-7-18(25)21-23-17-6-1-2-8-19(17)30-21/h1-2,5-6,8-9,15-16,18H,3-4,7,10-14H2/t18-/m1/s1