1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(2-dimethylaminoethyl)-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(2-dimethylaminoethyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-1-(1,1-dioxothiolan-3-yl)-5-phenyl-pyrazole-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-1-(1,1-dioxo-3-thiolanyl)-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-1-(1,1-dioxothiolan-3-yl)-5-phenylpyrazole-3-carboxamide Traditional Name: 1-(1,1-diketothiolan-3-yl)-N-(2-dimethylaminoethyl)-5-phenyl-pyrazole-3-carboxamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=NN(C(=C1)C2=CC=CC=C2)C3CCS(=O)(=O)C3

Isomeric SMILES

CN(C)CCNC(=O)C1=NN(C(=C1)C2=CC=CC=C2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C18H24N4O3S/c1-21(2)10-9-19-18(23)16-12-17(14-6-4-3-5-7-14)22(20-16)15-8-11-26(24,25)13-15/h3-7,12,15H,8-11,13H2,1-2H3,(H,19,23)