(2S)-2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-N-ethyl-propanamide Openeye Name: (2S)-2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-N-ethyl-propanamide CAS Name: (2S)-2-[4-(4-cyclohexylphenyl)sulfonyl-1-piperazinyl]-N-ethylpropanamide IUPAC Name: (2S)-2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-N-ethylpropanamide Traditional Name: (2S)-2-[4-(4-cyclohexylphenyl)sulfonylpiperazino]-N-ethyl-propionamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CCNC(=O)[C@H](C)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C21H33N3O3S/c1-3-22-21(25)17(2)23-13-15-24(16-14-23)28(26,27)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h9-12,17-18H,3-8,13-16H2,1-2H3,(H,22,25)/t17-/m0/s1