(3S)-4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one

Systemtic Name: (3S)-4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one Openeye Name: (3S)-4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one CAS Name: (3S)-4-[[2-ethylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]-1,3-dimethyl-2-piperazinone IUPAC Name: (3S)-4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-1,3-dimethylpiperazin-2-one Traditional Name: (3S)-4-[[2-esyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)CN3CCN(C(=O)C3C)C

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)CN3CCN(C(=O)[C@@H]3C)C

InChI

InChI=1S/C21H30N4O3S/c1-4-29(27,28)21-22-15-19(16-24-14-13-23(3)20(26)17(24)2)25(21)12-8-11-18-9-6-5-7-10-18/h5-7,9-10,15,17H,4,8,11-14,16H2,1-3H3/t17-/m0/s1