methyl (2S)-2-[[5-(5-methylfuran-2-yl)-1,2,4-triazin-3-yl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[5-(5-methylfuran-2-yl)-1,2,4-triazin-3-yl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[5-(5-methyl-2-furyl)-1,2,4-triazin-3-yl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[5-(5-methyl-2-furanyl)-1,2,4-triazin-3-yl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(5-methylfuran-2-yl)-1,2,4-triazin-3-yl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[5-(5-methyl-2-furyl)-1,2,4-triazin-3-yl]amino]-3-phenyl-propionic acid methyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=CN=NC(=N2)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(O1)C2=CN=NC(=N2)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H18N4O3/c1-12-8-9-16(25-12)15-11-19-22-18(21-15)20-14(17(23)24-2)10-13-6-4-3-5-7-13/h3-9,11,14H,10H2,1-2H3,(H,20,21,22)/t14-/m0/s1