[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: [2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: (2-indolin-1-yl-2-oxo-ethyl) (2R)-4-methylsulfanyl-2-ureido-butanoate CAS Name: (2R)-2-(carbamoylamino)-4-(methylthio)butanoic acid [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] (2R)-2-(carbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-ureido-butyric acid (2-indolin-1-yl-2-keto-ethyl) ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)N1CCC2=CC=CC=C21)NC(=O)N

Isomeric SMILES

CSCC[C@H](C(=O)OCC(=O)N1CCC2=CC=CC=C21)NC(=O)N

InChI

InChI=1S/C16H21N3O4S/c1-24-9-7-12(18-16(17)22)15(21)23-10-14(20)19-8-6-11-4-2-3-5-13(11)19/h2-5,12H,6-10H2,1H3,(H3,17,18,22)/t12-/m1/s1