(2S)-2-[2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-N-propyl-2-[[2-[4-[(E)-styryl]sulfonylpiperazin-1-yl]acetyl]amino]propanamide CAS Name: (2S)-2-[[1-oxo-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]ethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetyl]amino]-N-propylpropanamide Traditional Name: (2S)-N-propyl-2-[[2-[4-[(E)-styryl]sulfonylpiperazino]acetyl]amino]propionamide Formula: C20H30N4O4S MolecularWeight: 422.5416

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CN1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H30N4O4S/c1-3-10-21-20(26)17(2)22-19(25)16-23-11-13-24(14-12-23)29(27,28)15-9-18-7-5-4-6-8-18/h4-9,15,17H,3,10-14,16H2,1-2H3,(H,21,26)(H,22,25)/b15-9+/t17-/m0/s1