3-(1,3-benzothiazol-2-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3-thienylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3-thiophenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-[4-(3-thenyl)piperazino]propan-1-one Formula: C19H21N3OS2 MolecularWeight: 371.51954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H21N3OS2/c23-19(6-5-18-20-16-3-1-2-4-17(16)25-18)22-10-8-21(9-11-22)13-15-7-12-24-14-15/h1-4,7,12,14H,5-6,8-11,13H2