(2S)-2-azanyl-3-methyl-1-[2-(4-methylphenyl)sulfonylpyrazolidin-1-yl]pentan-1-one

Systemtic Name: (2S)-2-azanyl-3-methyl-1-[2-(4-methylphenyl)sulfonylpyrazolidin-1-yl]pentan-1-one Openeye Name: (2S)-2-amino-3-methyl-1-[2-(p-tolylsulfonyl)pyrazolidin-1-yl]pentan-1-one CAS Name: (2S)-2-amino-3-methyl-1-[2-(4-methylphenyl)sulfonyl-1-pyrazolidinyl]-1-pentanone IUPAC Name: (2S)-2-amino-3-methyl-1-[2-(4-methylphenyl)sulfonylpyrazolidin-1-yl]pentan-1-one Traditional Name: (2S)-2-amino-3-methyl-1-(2-tosylpyrazolidin-1-yl)pentan-1-one Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCN1S(=O)(=O)C2=CC=C(C=C2)C)N

Isomeric SMILES

CCC(C)[C@@H](C(=O)N1CCCN1S(=O)(=O)C2=CC=C(C=C2)C)N

InChI

InChI=1S/C16H25N3O3S/c1-4-13(3)15(17)16(20)18-10-5-11-19(18)23(21,22)14-8-6-12(2)7-9-14/h6-9,13,15H,4-5,10-11,17H2,1-3H3/t13?,15-/m0/s1