3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]benzonitrile CAS Name: 3-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]benzonitrile Formula: C20H17N3OS MolecularWeight: 347.43348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H17N3OS/c21-13-14-4-3-5-16(12-14)20(24)23-10-8-15(9-11-23)19-22-17-6-1-2-7-18(17)25-19/h1-7,12,15H,8-11H2