1-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one

Systemtic Name: 1-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one Openeye Name: 1-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one CAS Name: 1-[4-(4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-phenoxy-1-propanone IUPAC Name: 1-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-phenoxypropan-1-one Traditional Name: 1-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazino]-2-phenoxy-propan-1-one Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C(C)OC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C(C)OC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2S/c1-15-7-6-10-18-19(15)22-21(27-18)24-13-11-23(12-14-24)20(25)16(2)26-17-8-4-3-5-9-17/h3-10,16H,11-14H2,1-2H3