2-(4-chlorophenyl)sulfanyl-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-chlorophenyl)sulfanyl-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-[(4-chlorophenyl)thio]-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-chlorophenyl)sulfanyl-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-chlorophenyl)thio]-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C21H22ClN3O2S2 MolecularWeight: 448.00128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O2S2/c1-2-27-17-4-3-5-18-20(17)23-21(29-18)25-12-10-24(11-13-25)19(26)14-28-16-8-6-15(22)7-9-16/h3-9H,2,10-14H2,1H3