(2S)-2-(2-chloranyl-5-methyl-phenoxy)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: (2S)-2-(2-chloranyl-5-methyl-phenoxy)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: (2S)-2-(2-chloro-5-methyl-phenoxy)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one CAS Name: (2S)-2-(2-chloro-5-methylphenoxy)-1-(4-methylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: (2S)-2-(2-chloro-5-methylphenoxy)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: (2S)-2-(2-chloro-5-methyl-phenoxy)-1-(4-mesylpiperazino)propan-1-one Formula: C15H21ClN2O4S MolecularWeight: 360.85624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(C)C(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)O[C@@H](C)C(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C15H21ClN2O4S/c1-11-4-5-13(16)14(10-11)22-12(2)15(19)17-6-8-18(9-7-17)23(3,20)21/h4-5,10,12H,6-9H2,1-3H3/t12-/m0/s1