(3-bromophenyl)-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-(6-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C20H20BrN3O2S MolecularWeight: 446.3607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H20BrN3O2S/c1-2-26-16-6-7-17-18(13-16)27-20(22-17)24-10-8-23(9-11-24)19(25)14-4-3-5-15(21)12-14/h3-7,12-13H,2,8-11H2,1H3