[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-(4-iodophenyl)methanone

Systemtic Name: [4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-(4-iodophenyl)methanone Openeye Name: [4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-(4-iodophenyl)methanone CAS Name: [4-[1-(1,3-benzothiazol-2-yl)ethyl]-1-piperazinyl]-(4-iodophenyl)methanone IUPAC Name: [4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-(4-iodophenyl)methanone Traditional Name: [4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazino]-(4-iodophenyl)methanone Formula: C20H20IN3OS MolecularWeight: 477.36177

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N3CCN(CC3)C(=O)C4=CC=C(C=C4)I

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N3CCN(CC3)C(=O)C4=CC=C(C=C4)I

InChI

InChI=1S/C20H20IN3OS/c1-14(19-22-17-4-2-3-5-18(17)26-19)23-10-12-24(13-11-23)20(25)15-6-8-16(21)9-7-15/h2-9,14H,10-13H2,1H3