(2R)-1-(2,3-dihydroindol-1-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]propan-1-one Openeye Name: (2R)-1-indolin-1-yl-2-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]sulfanyl]propan-1-one CAS Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]thio]-1-propanone IUPAC Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]propan-1-one Traditional Name: (2R)-1-indolin-1-yl-2-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)thio]propan-1-one Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NC4=C(O3)C=CC(=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C21)SC3=NC4=C(O3)C=CC(=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C23H25N3O4S2/c1-16(22(27)26-14-11-17-7-3-4-8-20(17)26)31-23-24-19-15-18(9-10-21(19)30-23)32(28,29)25-12-5-2-6-13-25/h3-4,7-10,15-16H,2,5-6,11-14H2,1H3/t16-/m1/s1