(2S,3R)-3-[4-[(2-azanylethylamino)methyl]piperidin-1-yl]carbonyl-5-methyl-2-propyl-hexanamide

Systemtic Name: (2S,3R)-3-[4-[(2-azanylethylamino)methyl]piperidin-1-yl]carbonyl-5-methyl-2-propyl-hexanamide Openeye Name: (2S,3R)-3-[4-[(2-aminoethylamino)methyl]piperidine-1-carbonyl]-5-methyl-2-propyl-hexanamide CAS Name: (2S,3R)-3-[[4-[(2-aminoethylamino)methyl]-1-piperidinyl]-oxomethyl]-5-methyl-2-propylhexanamide IUPAC Name: (2S,3R)-3-[4-[(2-aminoethylamino)methyl]piperidine-1-carbonyl]-5-methyl-2-propylhexanamide Traditional Name: (2S,3R)-3-[4-[(2-aminoethylamino)methyl]piperidine-1-carbonyl]-5-methyl-2-propyl-hexanamide Formula: C19H38N4O2 MolecularWeight: 354.53062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCC(CC1)CNCCN)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCC(CC1)CNCCN)C(=O)N

InChI

InChI=1S/C19H38N4O2/c1-4-5-16(18(21)24)17(12-14(2)3)19(25)23-10-6-15(7-11-23)13-22-9-8-20/h14-17,22H,4-13,20H2,1-3H3,(H2,21,24)/t16-,17+/m0/s1