methyl 4-(3-azanyl-5-oxidanylidene-imidazo[2,1-c][1,2,4]triazol-6-yl)-3-oxidanylidene-2-propyl-pentanoate

Systemtic Name: methyl 4-(3-azanyl-5-oxidanylidene-imidazo[2,1-c][1,2,4]triazol-6-yl)-3-oxidanylidene-2-propyl-pentanoate Openeye Name: methyl 4-(3-amino-5-oxo-imidazo[2,1-c][1,2,4]triazol-6-yl)-3-oxo-2-propyl-pentanoate CAS Name: 4-(3-amino-5-oxo-6-imidazo[2,1-c][1,2,4]triazolyl)-3-oxo-2-propylpentanoic acid methyl ester IUPAC Name: methyl 4-(3-amino-5-oxoimidazo[2,1-c][1,2,4]triazol-6-yl)-3-oxo-2-propylpentanoate Traditional Name: 4-(3-amino-5-keto-imidazo[2,1-c][1,2,4]triazol-6-yl)-3-keto-2-propyl-valeric acid methyl ester Formula: C13H17N5O4 MolecularWeight: 307.30518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(C)C1=NC2=NN=C(N2C1=O)N)C(=O)OC

Isomeric SMILES

CCCC(C(=O)C(C)C1=NC2=NN=C(N2C1=O)N)C(=O)OC

InChI

InChI=1S/C13H17N5O4/c1-4-5-7(11(21)22-3)9(19)6(2)8-10(20)18-12(14)16-17-13(18)15-8/h6-7H,4-5H2,1-3H3,(H2,14,16)