[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] (2R)-4-methylsulfanyl-2-ureido-butanoate CAS Name: (2R)-2-(carbamoylamino)-4-(methylthio)butanoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] (2R)-2-(carbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-ureido-butyric acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)NCC1=CC=CC=C1)NC(=O)N

Isomeric SMILES

CSCC[C@H](C(=O)OCC(=O)NCC1=CC=CC=C1)NC(=O)N

InChI

InChI=1S/C15H21N3O4S/c1-23-8-7-12(18-15(16)21)14(20)22-10-13(19)17-9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,17,19)(H3,16,18,21)/t12-/m1/s1