1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one

Systemtic Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Openeye Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one CAS Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3-(1-phenyl-4-pyrazolyl)-1-propanone IUPAC Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Traditional Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-3-(1-phenylpyrazol-4-yl)propan-1-one Formula: C23H22N4OS MolecularWeight: 402.51198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC2=CN(N=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CCC2=CN(N=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H22N4OS/c28-22(13-12-17-15-24-27(16-17)18-7-2-1-3-8-18)26-14-6-10-20(26)23-25-19-9-4-5-11-21(19)29-23/h1-5,7-9,11,15-16,20H,6,10,12-14H2/t20-/m1/s1