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

Systemtic Name: 7-chloranyl-4-methyl-2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Openeye Name: 7-chloro-4-methyl-2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 7-chloro-4-methyl-2-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 7-chloro-4-methyl-2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Traditional Name: 7-chloro-4-methyl-2-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]piperazino]-1,3-benzothiazole Formula: C20H19ClN4S3 MolecularWeight: 447.03966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)SC

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)SC

InChI

InChI=1S/C20H19ClN4S3/c1-12-3-5-14(21)18-17(12)23-20(28-18)25-9-7-24(8-10-25)19-22-15-6-4-13(26-2)11-16(15)27-19/h3-6,11H,7-10H2,1-2H3