1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(1H-indol-3-yl)butan-1-one

Systemtic Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(1H-indol-3-yl)butan-1-one Openeye Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-(1H-indol-3-yl)butan-1-one CAS Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-(1H-indol-3-yl)-1-butanone IUPAC Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(1H-indol-3-yl)butan-1-one Traditional Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-4-(1H-indol-3-yl)butan-1-one Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCCC2=CNC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)CCCC2=CNC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H25N3OS/c28-23(13-5-7-17-15-25-20-10-2-1-9-19(17)20)27-14-6-8-18(16-27)24-26-21-11-3-4-12-22(21)29-24/h1-4,9-12,15,18,25H,5-8,13-14,16H2/t18-/m1/s1