N-[(2S)-3-cyclohexyl-1-(2-morpholin-4-ylethylamino)-1-oxidanylidene-propan-2-yl]-2-(1-oxidanyl-2-sulfanyl-ethyl)nonanamide

Systemtic Name: N-[(2S)-3-cyclohexyl-1-(2-morpholin-4-ylethylamino)-1-oxidanylidene-propan-2-yl]-2-(1-oxidanyl-2-sulfanyl-ethyl)nonanamide Openeye Name: N-[(1S)-1-(cyclohexylmethyl)-2-(2-morpholinoethylamino)-2-oxo-ethyl]-2-(1-hydroxy-2-sulfanyl-ethyl)nonanamide CAS Name: N-[(2S)-3-cyclohexyl-1-[2-(4-morpholinyl)ethylamino]-1-oxopropan-2-yl]-2-(1-hydroxy-2-mercaptoethyl)nonanamide IUPAC Name: N-[(2S)-3-cyclohexyl-1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]-2-(1-hydroxy-2-sulfanylethyl)nonanamide Traditional Name: N-[(1S)-1-(cyclohexylmethyl)-2-keto-2-(2-morpholinoethylamino)ethyl]-2-(1-hydroxy-2-mercapto-ethyl)pelargonamide Formula: C26H49N3O4S MolecularWeight: 499.74996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(CS)O)C(=O)NC(CC1CCCCC1)C(=O)NCCN2CCOCC2

Isomeric SMILES

CCCCCCCC(C(CS)O)C(=O)N[C@@H](CC1CCCCC1)C(=O)NCCN2CCOCC2

InChI

InChI=1S/C26H49N3O4S/c1-2-3-4-5-9-12-22(24(30)20-34)25(31)28-23(19-21-10-7-6-8-11-21)26(32)27-13-14-29-15-17-33-18-16-29/h21-24,30,34H,2-20H2,1H3,(H,27,32)(H,28,31)/t22?,23-,24?/m0/s1