methyl 2-[[2-azanyl-5-(1,2,4-triazol-1-yl)phenyl]methylamino]ethanoate

Systemtic Name: methyl 2-[[2-azanyl-5-(1,2,4-triazol-1-yl)phenyl]methylamino]ethanoate Openeye Name: methyl 2-[[2-amino-5-(1,2,4-triazol-1-yl)phenyl]methylamino]acetate CAS Name: 2-[[2-amino-5-(1,2,4-triazol-1-yl)phenyl]methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-amino-5-(1,2,4-triazol-1-yl)phenyl]methylamino]acetate Traditional Name: 2-[[2-amino-5-(1,2,4-triazol-1-yl)benzyl]amino]acetic acid methyl ester Formula: C12H15N5O2 MolecularWeight: 261.2798

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNCC1=C(C=CC(=C1)N2C=NC=N2)N

Isomeric SMILES

COC(=O)CNCC1=C(C=CC(=C1)N2C=NC=N2)N

InChI

InChI=1S/C12H15N5O2/c1-19-12(18)6-14-5-9-4-10(2-3-11(9)13)17-8-15-7-16-17/h2-4,7-8,14H,5-6,13H2,1H3