[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone

Systemtic Name: [4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Openeye Name: [4-(1,3-benzoxazol-2-yl)-1-piperidyl]-[(3S)-1-(2-thienylsulfonyl)-3-piperidyl]methanone CAS Name: [4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-[(3S)-1-thiophen-2-ylsulfonyl-3-piperidinyl]methanone IUPAC Name: [4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Traditional Name: [4-(1,3-benzoxazol-2-yl)piperidino]-[(3S)-1-(2-thienylsulfonyl)-3-piperidyl]methanone Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H25N3O4S2/c26-22(17-5-3-11-25(15-17)31(27,28)20-8-4-14-30-20)24-12-9-16(10-13-24)21-23-18-6-1-2-7-19(18)29-21/h1-2,4,6-8,14,16-17H,3,5,9-13,15H2/t17-/m0/s1