methyl (2R)-2-[2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[[2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[2-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)acetyl]amino]propionic acid methyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)CC(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C20H22N4O4/c1-11-15(19(26)23-12(2)22-11)9-18(25)24-17(20(27)28-3)8-13-10-21-16-7-5-4-6-14(13)16/h4-7,10,17,21H,8-9H2,1-3H3,(H,24,25)(H,22,23,26)/t17-/m1/s1