1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-3,3-diphenyl-propan-1-one Formula: C26H24N2OS MolecularWeight: 412.54656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H24N2OS/c29-25(18-21(19-10-3-1-4-11-19)20-12-5-2-6-13-20)28-17-9-15-23(28)26-27-22-14-7-8-16-24(22)30-26/h1-8,10-14,16,21,23H,9,15,17-18H2/t23-/m1/s1