N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2,5-diphenyl-pyrazole-3-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2,5-diphenyl-pyrazole-3-carboxamide Openeye Name: N-butyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2,5-diphenyl-pyrazole-3-carboxamide CAS Name: N-butyl-N-[(3S)-1,1-dioxo-3-thiolanyl]-2,5-diphenyl-3-pyrazolecarboxamide IUPAC Name: N-butyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2,5-diphenylpyrazole-3-carboxamide Traditional Name: N-butyl-N-[(3S)-1,1-diketothiolan-3-yl]-2,5-diphenyl-pyrazole-3-carboxamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN([C@H]1CCS(=O)(=O)C1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3S/c1-2-3-15-26(21-14-16-31(29,30)18-21)24(28)23-17-22(19-10-6-4-7-11-19)25-27(23)20-12-8-5-9-13-20/h4-13,17,21H,2-3,14-16,18H2,1H3/t21-/m0/s1