3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-prop-2-ynylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-prop-2-ynylsulfanyl-1,2,4-triazole Openeye Name: 3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-prop-2-ynylsulfanyl-1,2,4-triazole CAS Name: 3-(3-methoxy-1-methyl-4-pyrazolyl)-4-methyl-5-(prop-2-ynylthio)-1,2,4-triazole IUPAC Name: 3-(3-methoxy-1-methylpyrazol-4-yl)-4-methyl-5-prop-2-ynylsulfanyl-1,2,4-triazole Traditional Name: 3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-(propargylthio)-1,2,4-triazole Formula: C11H13N5OS MolecularWeight: 263.31882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)OC)C2=NN=C(N2C)SCC#C

Isomeric SMILES

CN1C=C(C(=N1)OC)C2=NN=C(N2C)SCC#C

InChI

InChI=1S/C11H13N5OS/c1-5-6-18-11-13-12-9(16(11)3)8-7-15(2)14-10(8)17-4/h1,7H,6H2,2-4H3