N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-(4-chlorophenyl)-2-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-(4-chlorophenyl)-2-phenyl-pyrazole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-(1,1-dioxothiolan-3-yl)-2-phenyl-pyrazole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-N-(1,1-dioxo-3-thiolanyl)-2-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-(1,1-dioxothiolan-3-yl)-2-phenylpyrazole-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-(1,1-diketothiolan-3-yl)-2-phenyl-pyrazole-3-carboxamide Formula: C20H18ClN3O3S MolecularWeight: 415.89322

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN3O3S/c21-15-8-6-14(7-9-15)18-12-19(24(23-18)17-4-2-1-3-5-17)20(25)22-16-10-11-28(26,27)13-16/h1-9,12,16H,10-11,13H2,(H,22,25)