4-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]benzenecarbonitrile Openeye Name: 4-[2-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]benzonitrile CAS Name: 4-[2-[(3R)-3-(1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazol-6-yl]benzonitrile IUPAC Name: 4-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]benzonitrile Traditional Name: 4-[2-[(3R)-3-piperidinopyrrolidino]-1,3-benzothiazol-6-yl]benzonitrile Formula: C23H24N4S MolecularWeight: 388.52846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(C2)C3=NC4=C(S3)C=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CCN(CC1)[C@@H]2CCN(C2)C3=NC4=C(S3)C=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C23H24N4S/c24-15-17-4-6-18(7-5-17)19-8-9-21-22(14-19)28-23(25-21)27-13-10-20(16-27)26-11-2-1-3-12-26/h4-9,14,20H,1-3,10-13,16H2/t20-/m1/s1