6-chloranyl-4-methyl-2-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 6-chloranyl-4-methyl-2-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Openeye Name: 6-chloro-4-methyl-2-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 6-chloro-4-methyl-2-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 6-chloro-4-methyl-2-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Traditional Name: 6-chloro-2-[4-(6-mesyl-1,3-benzothiazol-2-yl)piperazino]-4-methyl-1,3-benzothiazole Formula: C20H19ClN4O2S3 MolecularWeight: 479.03846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H19ClN4O2S3/c1-12-9-13(21)10-17-18(12)23-20(29-17)25-7-5-24(6-8-25)19-22-15-4-3-14(30(2,26)27)11-16(15)28-19/h3-4,9-11H,5-8H2,1-2H3