methyl 2-[2-[(2,4-dichlorophenyl)methylamino]-5-methyl-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(2,4-dichlorophenyl)methylamino]-5-methyl-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(2,4-dichlorophenyl)methylamino]-5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetate CAS Name: 2-[2-[(2,4-dichlorophenyl)methylamino]-5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2,4-dichlorophenyl)methylamino]-5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetate Traditional Name: 2-[2-[(2,4-dichlorobenzyl)amino]-7-keto-5-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetic acid methyl ester Formula: C16H15Cl2N5O3 MolecularWeight: 396.228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)N=C(N2)NCC3=C(C=C(C=C3)Cl)Cl)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)N=C(N2)NCC3=C(C=C(C=C3)Cl)Cl)CC(=O)OC

InChI

InChI=1S/C16H15Cl2N5O3/c1-8-11(6-13(24)26-2)14(25)23-16(20-8)21-15(22-23)19-7-9-3-4-10(17)5-12(9)18/h3-5H,6-7H2,1-2H3,(H2,19,20,21,22)