methyl (2S)-2-[2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]-3-(1-methylindol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-[2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]-3-(1-methylindol-3-yl)propanoate Openeye Name: methyl (2S)-2-[[2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)acetyl]amino]-3-(1-methylindol-3-yl)propanoate CAS Name: (2S)-2-[[2-(5-methyl-2,4-dioxo-1-pyrimidinyl)-1-oxoethyl]amino]-3-(1-methyl-3-indolyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]-3-(1-methylindol-3-yl)propanoate Traditional Name: (2S)-2-[[2-(2,4-diketo-5-methyl-pyrimidin-1-yl)acetyl]amino]-3-(1-methylindol-3-yl)propionic acid methyl ester Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CC(=O)NC(CC2=CN(C3=CC=CC=C32)C)C(=O)OC

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CC(=O)N[C@@H](CC2=CN(C3=CC=CC=C32)C)C(=O)OC

InChI

InChI=1S/C20H22N4O5/c1-12-9-24(20(28)22-18(12)26)11-17(25)21-15(19(27)29-3)8-13-10-23(2)16-7-5-4-6-14(13)16/h4-7,9-10,15H,8,11H2,1-3H3,(H,21,25)(H,22,26,28)/t15-/m0/s1