tert-butyl N-[(2S)-4,4-dimethyl-1-[[(2S)-4-methylsulfanyl-1-(2-morpholin-4-ylethylamino)-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4,4-dimethyl-1-[[(2S)-4-methylsulfanyl-1-(2-morpholin-4-ylethylamino)-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-3,3-dimethyl-1-[[(1S)-3-methylsulfanyl-1-(2-morpholinoethylcarbamoyl)propyl]carbamoyl]butyl]carbamate CAS Name: N-[(2S)-4,4-dimethyl-1-[[(2S)-4-(methylthio)-1-[2-(4-morpholinyl)ethylamino]-1-oxobutan-2-yl]amino]-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4,4-dimethyl-1-[[(2S)-4-methylsulfanyl-1-(2-morpholin-4-ylethylamino)-1-oxobutan-2-yl]amino]-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-3,3-dimethyl-1-[[(1S)-3-(methylthio)-1-(2-morpholinoethylcarbamoyl)propyl]carbamoyl]butyl]carbamic acid tert-butyl ester Formula: C23H44N4O5S MolecularWeight: 488.68426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)NC(CCSC)C(=O)NCCN1CCOCC1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)NCCN1CCOCC1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H44N4O5S/c1-22(2,3)16-18(26-21(30)32-23(4,5)6)20(29)25-17(8-15-33-7)19(28)24-9-10-27-11-13-31-14-12-27/h17-18H,8-16H2,1-7H3,(H,24,28)(H,25,29)(H,26,30)/t17-,18-/m0/s1