[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-iodanylphenyl)methanone

Systemtic Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-iodanylphenyl)methanone Openeye Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-iodophenyl)methanone CAS Name: [4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(3-iodophenyl)methanone IUPAC Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-iodophenyl)methanone Traditional Name: [4-(2,4-dimethylphenyl)sulfonylpiperazino]-(3-iodophenyl)methanone Formula: C19H21IN2O3S MolecularWeight: 484.35111

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)I)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)I)C

InChI

InChI=1S/C19H21IN2O3S/c1-14-6-7-18(15(2)12-14)26(24,25)22-10-8-21(9-11-22)19(23)16-4-3-5-17(20)13-16/h3-7,12-13H,8-11H2,1-2H3