1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 2-(1-allylbenzimidazol-2-yl)sulfanyl-1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]ethanone CAS Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 2-[(1-allylbenzimidazol-2-yl)thio]-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]ethanone Formula: C24H24N4OS2 MolecularWeight: 448.60356

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N=C1SCC(=O)N3CCCC(C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C=CCN1C2=CC=CC=C2N=C1SCC(=O)N3CCC[C@H](C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H24N4OS2/c1-2-13-28-20-11-5-3-9-18(20)26-24(28)30-16-22(29)27-14-7-8-17(15-27)23-25-19-10-4-6-12-21(19)31-23/h2-6,9-12,17H,1,7-8,13-16H2/t17-/m1/s1