1-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 1-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]-3,3-dimethyl-butan-2-one Formula: C11H19N3O2S MolecularWeight: 257.35246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=CN1CCOC

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=CN1CCOC

InChI

InChI=1S/C11H19N3O2S/c1-11(2,3)9(15)7-17-10-13-12-8-14(10)5-6-16-4/h8H,5-7H2,1-4H3