N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-2-yl]ethanamide

Systemtic Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-2-yl]ethanamide Openeye Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-2-[(2R)-3-oxo-1-phenethyl-piperazin-2-yl]acetamide CAS Name: N-[2-[(1-methyl-2-imidazolyl)thio]ethyl]-2-[(2R)-3-oxo-1-phenethyl-2-piperazinyl]acetamide IUPAC Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-2-[(2R)-3-oxo-1-phenethylpiperazin-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-phenethyl-piperazin-2-yl]-N-[2-[(1-methylimidazol-2-yl)thio]ethyl]acetamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCNC(=O)CC2C(=O)NCCN2CCC3=CC=CC=C3

Isomeric SMILES

CN1C=CN=C1SCCNC(=O)C[C@@H]2C(=O)NCCN2CCC3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2S/c1-24-12-8-23-20(24)28-14-10-21-18(26)15-17-19(27)22-9-13-25(17)11-7-16-5-3-2-4-6-16/h2-6,8,12,17H,7,9-11,13-15H2,1H3,(H,21,26)(H,22,27)/t17-/m1/s1