[4-(6-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-iodanylphenyl)methanone

Systemtic Name: [4-(6-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-iodanylphenyl)methanone Openeye Name: [4-(6-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-iodophenyl)methanone CAS Name: [4-(6-ethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-(2-iodophenyl)methanone IUPAC Name: [4-(6-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-iodophenyl)methanone Traditional Name: [4-(6-ethyl-1,3-benzothiazol-2-yl)piperazino]-(2-iodophenyl)methanone Formula: C20H20IN3OS MolecularWeight: 477.36177

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)C4=CC=CC=C4I

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)C4=CC=CC=C4I

InChI

InChI=1S/C20H20IN3OS/c1-2-14-7-8-17-18(13-14)26-20(22-17)24-11-9-23(10-12-24)19(25)15-5-3-4-6-16(15)21/h3-8,13H,2,9-12H2,1H3