1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]sulfanyl]ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]thio]ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)thio]ethanone Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C23H25N3O4S2/c27-22(26-14-6-8-17-7-2-3-9-20(17)26)16-31-23-24-19-15-18(10-11-21(19)30-23)32(28,29)25-12-4-1-5-13-25/h2-3,7,9-11,15H,1,4-6,8,12-14,16H2