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

Systemtic Name: 2-[4-(6-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-6-methylsulfanyl-1,3-benzothiazole Openeye Name: 2-[4-(6-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-6-methylsulfanyl-1,3-benzothiazole CAS Name: 2-[4-(6-ethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-6-(methylthio)-1,3-benzothiazole IUPAC Name: 2-[4-(6-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-6-methylsulfanyl-1,3-benzothiazole Traditional Name: 2-[4-(6-ethyl-1,3-benzothiazol-2-yl)piperazino]-6-(methylthio)-1,3-benzothiazole Formula: C21H22N4S3 MolecularWeight: 426.62118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)SC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)SC

InChI

InChI=1S/C21H22N4S3/c1-3-14-4-6-16-18(12-14)27-20(22-16)24-8-10-25(11-9-24)21-23-17-7-5-15(26-2)13-19(17)28-21/h4-7,12-13H,3,8-11H2,1-2H3