1,3-benzodioxol-5-yl-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[(4-phenylthiazol-2-yl)methyl]piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[(4-phenyl-2-thiazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-[(4-phenylthiazol-2-yl)methyl]piperazino]methanone Formula: C22H21N3O3S MolecularWeight: 407.48544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=CS2)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=NC(=CS2)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N3O3S/c26-22(17-6-7-19-20(12-17)28-15-27-19)25-10-8-24(9-11-25)13-21-23-18(14-29-21)16-4-2-1-3-5-16/h1-7,12,14H,8-11,13,15H2