4-ethoxy-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 4-ethoxy-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole Openeye Name: 4-ethoxy-2-[4-(p-tolylsulfonyl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 4-ethoxy-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 4-ethoxy-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole Traditional Name: 4-ethoxy-2-(4-tosylpiperazino)-1,3-benzothiazole Formula: C20H23N3O3S2 MolecularWeight: 417.54492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C20H23N3O3S2/c1-3-26-17-5-4-6-18-19(17)21-20(27-18)22-11-13-23(14-12-22)28(24,25)16-9-7-15(2)8-10-16/h4-10H,3,11-14H2,1-2H3