tert-butyl N-[(2S)-1-(3-aminocarbonylpentan-3-ylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(3-aminocarbonylpentan-3-ylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(1-carbamoyl-1-ethyl-propyl)carbamoyl]-3-methylsulfanyl-propyl]carbamate CAS Name: N-[(2S)-1-(3-carbamoylpentan-3-ylamino)-4-(methylthio)-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(3-carbamoylpentan-3-ylamino)-4-methylsulfanyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(1-carbamoyl-1-ethyl-propyl)carbamoyl]-3-(methylthio)propyl]carbamic acid tert-butyl ester Formula: C16H31N3O4S MolecularWeight: 361.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)N)NC(=O)C(CCSC)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H31N3O4S/c1-7-16(8-2,13(17)21)19-12(20)11(9-10-24-6)18-14(22)23-15(3,4)5/h11H,7-10H2,1-6H3,(H2,17,21)(H,18,22)(H,19,20)/t11-/m0/s1