1-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylpiperidin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylpiperidin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-1-piperidyl]-3-phenyl-propan-1-one CAS Name: 1-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-1-piperidinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]piperidin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]piperidino]-3-phenyl-propan-1-one Formula: C27H31N3O2S MolecularWeight: 461.61894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4CCN(CC4)C(=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4CCN(CC4)C(=O)CCC5=CC=CC=C5

InChI

InChI=1S/C27H31N3O2S/c31-25(11-10-20-6-2-1-3-7-20)29-16-14-22(15-17-29)27(32)30-18-12-21(13-19-30)26-28-23-8-4-5-9-24(23)33-26/h1-9,21-22H,10-19H2