methyl 2-[(3-azanyl-1H-1,2,4-triazol-5-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(3-azanyl-1H-1,2,4-triazol-5-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(3-amino-1H-1,2,4-triazole-5-carbonyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(3-amino-1H-1,2,4-triazol-5-yl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(3-amino-1H-1,2,4-triazole-5-carbonyl)amino]-3-phenylpropanoate Traditional Name: 2-[(3-amino-1H-1,2,4-triazole-5-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC(=NN2)N

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC(=NN2)N

InChI

InChI=1S/C13H15N5O3/c1-21-12(20)9(7-8-5-3-2-4-6-8)15-11(19)10-16-13(14)18-17-10/h2-6,9H,7H2,1H3,(H,15,19)(H3,14,16,17,18)