1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-methyl-5-piperidin-1-yl-pyrazole-4-carbaldehyde

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-methyl-5-piperidin-1-yl-pyrazole-4-carbaldehyde Openeye Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-3-methyl-5-(1-piperidyl)pyrazole-4-carbaldehyde CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-3-methyl-5-(1-piperidinyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-3-methyl-5-piperidin-1-ylpyrazole-4-carbaldehyde Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-3-methyl-5-piperidino-pyrazole-4-carbaldehyde Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)N2CCCCC2)C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=NN(C(=C1C=O)N2CCCCC2)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C14H21N3O3S/c1-11-13(9-18)14(16-6-3-2-4-7-16)17(15-11)12-5-8-21(19,20)10-12/h9,12H,2-8,10H2,1H3/t12-/m0/s1