methyl 4-[[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]amino]butanoate

Systemtic Name: methyl 4-[[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]amino]butanoate Openeye Name: methyl 4-[[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]amino]butanoate CAS Name: 4-[[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]amino]butanoate Traditional Name: 4-[[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]amino]butyric acid methyl ester Formula: C14H15ClN4O2 MolecularWeight: 306.7475

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC1=NC(=CN=N1)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCNC1=NC(=CN=N1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H15ClN4O2/c1-21-13(20)3-2-8-16-14-18-12(9-17-19-14)10-4-6-11(15)7-5-10/h4-7,9H,2-3,8H2,1H3,(H,16,18,19)