2-[piperazin-1-yl-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzothiazole

Systemtic Name: 2-[piperazin-1-yl-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzothiazole Openeye Name: 2-[piperazin-1-yl-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzothiazole CAS Name: 2-[1-piperazinyl-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[piperazin-1-yl-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzothiazole Traditional Name: 2-[piperazino-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzothiazole Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C2=NC3=CC=CC=C3S2)N4CCNCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(C2=NC3=CC=CC=C3S2)N4CCNCC4

InChI

InChI=1S/C21H25N3O3S/c1-25-16-12-14(13-17(26-2)20(16)27-3)19(24-10-8-22-9-11-24)21-23-15-6-4-5-7-18(15)28-21/h4-7,12-13,19,22H,8-11H2,1-3H3