3-[(2S)-butan-2-yl]sulfanyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[(2S)-butan-2-yl]sulfanyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole Openeye Name: 3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-[(1S)-1-methylpropyl]sulfanyl-1,2,4-triazole CAS Name: 3-[[(2S)-butan-2-yl]thio]-5-(3-methoxy-1-methyl-4-pyrazolyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[(2S)-butan-2-yl]sulfanyl-5-(3-methoxy-1-methylpyrazol-4-yl)-4-methyl-1,2,4-triazole Traditional Name: 3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-[[(1S)-1-methylpropyl]thio]-1,2,4-triazole Formula: C12H19N5OS MolecularWeight: 281.37716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)SC1=NN=C(N1C)C2=CN(N=C2OC)C

InChI

InChI=1S/C12H19N5OS/c1-6-8(2)19-12-14-13-10(17(12)4)9-7-16(3)15-11(9)18-5/h7-8H,6H2,1-5H3/t8-/m0/s1