methyl 2-[[5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]butanoate

Systemtic Name: methyl 2-[[5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]butanoate Openeye Name: methyl 2-[[5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]butanoate CAS Name: 2-[[5-(3-methoxy-1-methyl-4-pyrazolyl)-4-methyl-1,2,4-triazol-3-yl]thio]butanoic acid methyl ester IUPAC Name: methyl 2-[[5-(3-methoxy-1-methylpyrazol-4-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]butanoate Traditional Name: 2-[[5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazol-3-yl]thio]butyric acid methyl ester Formula: C13H19N5O3S MolecularWeight: 325.38666

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC)SC1=NN=C(N1C)C2=CN(N=C2OC)C

Isomeric SMILES

CCC(C(=O)OC)SC1=NN=C(N1C)C2=CN(N=C2OC)C

InChI

InChI=1S/C13H19N5O3S/c1-6-9(12(19)21-5)22-13-15-14-10(18(13)3)8-7-17(2)16-11(8)20-4/h7,9H,6H2,1-5H3