1-[(2S)-2-[5-[4-(phenylmethyl)piperazin-1-yl]sulfonylpyridin-2-yl]sulfanylpropanoyl]imidazolidin-2-one

Systemtic Name: 1-[(2S)-2-[5-[4-(phenylmethyl)piperazin-1-yl]sulfonylpyridin-2-yl]sulfanylpropanoyl]imidazolidin-2-one Openeye Name: 1-[(2S)-2-[[5-(4-benzylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]propanoyl]imidazolidin-2-one CAS Name: 1-[(2S)-1-oxo-2-[[5-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-2-pyridinyl]thio]propyl]-2-imidazolidinone IUPAC Name: 1-[(2S)-2-[5-(4-benzylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylpropanoyl]imidazolidin-2-one Traditional Name: 1-[(2S)-2-[[5-(4-benzylpiperazino)sulfonyl-2-pyridyl]thio]propanoyl]-2-imidazolidinone Formula: C22H27N5O4S2 MolecularWeight: 489.61088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNC1=O)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)N1CCNC1=O)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N5O4S2/c1-17(21(28)27-10-9-23-22(27)29)32-20-8-7-19(15-24-20)33(30,31)26-13-11-25(12-14-26)16-18-5-3-2-4-6-18/h2-8,15,17H,9-14,16H2,1H3,(H,23,29)/t17-/m0/s1