[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl] (2R)-4-methylsulfanyl-2-ureido-butanoate CAS Name: (2R)-2-(carbamoylamino)-4-(methylthio)butanoic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] (2R)-2-(carbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-ureido-butyric acid [2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl] ester Formula: C18H24N4O4S MolecularWeight: 392.47256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)NCCC1=CNC2=CC=CC=C21)NC(=O)N

Isomeric SMILES

CSCC[C@H](C(=O)OCC(=O)NCCC1=CNC2=CC=CC=C21)NC(=O)N

InChI

InChI=1S/C18H24N4O4S/c1-27-9-7-15(22-18(19)25)17(24)26-11-16(23)20-8-6-12-10-21-14-5-3-2-4-13(12)14/h2-5,10,15,21H,6-9,11H2,1H3,(H,20,23)(H3,19,22,25)/t15-/m1/s1