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

Systemtic Name: 6-chloranyl-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole Openeye Name: 6-chloro-2-[4-(p-tolylsulfonyl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 6-chloro-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 6-chloro-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole Traditional Name: 6-chloro-2-(4-tosylpiperazino)-1,3-benzothiazole Formula: C18H18ClN3O2S2 MolecularWeight: 407.93742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C18H18ClN3O2S2/c1-13-2-5-15(6-3-13)26(23,24)22-10-8-21(9-11-22)18-20-16-7-4-14(19)12-17(16)25-18/h2-7,12H,8-11H2,1H3