(3R)-N3-[(2S)-1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-4-ethanoyl-N1-propan-2-yl-piperazine-1,3-dicarboxamide

Systemtic Name: (3R)-N3-[(2S)-1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-4-ethanoyl-N1-propan-2-yl-piperazine-1,3-dicarboxamide Openeye Name: (3R)-4-acetyl-N3-[(1S)-2-amino-1-(cyclohexylmethyl)-2-oxo-ethyl]-N1-isopropyl-piperazine-1,3-dicarboxamide CAS Name: (3R)-4-acetyl-N3-[(2S)-1-amino-3-cyclohexyl-1-oxopropan-2-yl]-N1-propan-2-ylpiperazine-1,3-dicarboxamide IUPAC Name: (3R)-4-acetyl-3-N-[(2S)-1-amino-3-cyclohexyl-1-oxopropan-2-yl]-1-N-propan-2-ylpiperazine-1,3-dicarboxamide Traditional Name: (3R)-4-acetyl-N'-[(1S)-2-amino-1-(cyclohexylmethyl)-2-keto-ethyl]-N-isopropyl-piperazine-1,3-dicarboxamide Formula: C20H35N5O4 MolecularWeight: 409.523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCN(C(C1)C(=O)NC(CC2CCCCC2)C(=O)N)C(=O)C

Isomeric SMILES

CC(C)NC(=O)N1CCN([C@H](C1)C(=O)N[C@@H](CC2CCCCC2)C(=O)N)C(=O)C

InChI

InChI=1S/C20H35N5O4/c1-13(2)22-20(29)24-9-10-25(14(3)26)17(12-24)19(28)23-16(18(21)27)11-15-7-5-4-6-8-15/h13,15-17H,4-12H2,1-3H3,(H2,21,27)(H,22,29)(H,23,28)/t16-,17+/m0/s1