N-[[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]methyl]-3-methyl-butan-1-amine

Systemtic Name: N-[[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]methyl]-3-methyl-butan-1-amine Openeye Name: N-[[1-(1,1-dioxothiolan-3-yl)-3,5-dimethyl-pyrazol-4-yl]methyl]-3-methyl-butan-1-amine CAS Name: N-[[1-(1,1-dioxo-3-thiolanyl)-3,5-dimethyl-4-pyrazolyl]methyl]-3-methyl-1-butanamine IUPAC Name: N-[[1-(1,1-dioxothiolan-3-yl)-3,5-dimethylpyrazol-4-yl]methyl]-3-methylbutan-1-amine Traditional Name: [1-(1,1-diketothiolan-3-yl)-3,5-dimethyl-pyrazol-4-yl]methyl-isoamyl-amine Formula: C15H27N3O2S MolecularWeight: 313.45878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)CNCCC(C)C

Isomeric SMILES

CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)CNCCC(C)C

InChI

InChI=1S/C15H27N3O2S/c1-11(2)5-7-16-9-15-12(3)17-18(13(15)4)14-6-8-21(19,20)10-14/h11,14,16H,5-10H2,1-4H3