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

Systemtic Name: N-[2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-phenyl-pyrazol-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-[(3S)-1,1-dioxothiolan-3-yl]-5-phenyl-pyrazol-3-yl]-2-phenyl-acetamide CAS Name: N-[2-[(3S)-1,1-dioxo-3-thiolanyl]-5-phenyl-3-pyrazolyl]-2-phenylacetamide IUPAC Name: N-[2-[(3S)-1,1-dioxothiolan-3-yl]-5-phenylpyrazol-3-yl]-2-phenylacetamide Traditional Name: N-[2-[(3S)-1,1-diketothiolan-3-yl]-5-phenyl-pyrazol-3-yl]-2-phenyl-acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C(=CC(=N2)C3=CC=CC=C3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N2C(=CC(=N2)C3=CC=CC=C3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S/c25-21(13-16-7-3-1-4-8-16)22-20-14-19(17-9-5-2-6-10-17)23-24(20)18-11-12-28(26,27)15-18/h1-10,14,18H,11-13,15H2,(H,22,25)/t18-/m0/s1