N-[2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-phenyl-pyrazol-3-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-phenyl-pyrazol-3-yl]-2,2-dimethyl-propanamide Openeye Name: N-[2-[(3S)-1,1-dioxothiolan-3-yl]-5-phenyl-pyrazol-3-yl]-2,2-dimethyl-propanamide CAS Name: N-[2-[(3S)-1,1-dioxo-3-thiolanyl]-5-phenyl-3-pyrazolyl]-2,2-dimethylpropanamide IUPAC Name: N-[2-[(3S)-1,1-dioxothiolan-3-yl]-5-phenylpyrazol-3-yl]-2,2-dimethylpropanamide Traditional Name: N-[2-[(3S)-1,1-diketothiolan-3-yl]-5-phenyl-pyrazol-3-yl]-2,2-dimethyl-propionamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=NN1C2CCS(=O)(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=NN1[C@H]2CCS(=O)(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C18H23N3O3S/c1-18(2,3)17(22)19-16-11-15(13-7-5-4-6-8-13)20-21(16)14-9-10-25(23,24)12-14/h4-8,11,14H,9-10,12H2,1-3H3,(H,19,22)/t14-/m0/s1