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

Systemtic Name: 1-[1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]-N-methyl-methanamine Openeye Name: 1-[1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]-N-methyl-methanamine CAS Name: 1-[1-[(3S)-1,1-dioxo-3-thiolanyl]-3,5-dimethyl-4-pyrazolyl]-N-methylmethanamine IUPAC Name: 1-[1-[(3S)-1,1-dioxothiolan-3-yl]-3,5-dimethylpyrazol-4-yl]-N-methylmethanamine Traditional Name: [1-[(3S)-1,1-diketothiolan-3-yl]-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-amine Formula: C11H19N3O2S MolecularWeight: 257.35246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=NN1[C@H]2CCS(=O)(=O)C2)C)CNC

InChI

InChI=1S/C11H19N3O2S/c1-8-11(6-12-3)9(2)14(13-8)10-4-5-17(15,16)7-10/h10,12H,4-7H2,1-3H3/t10-/m0/s1