N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[(1,1-dioxothiolan-3-yl)methyl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[(1,1-dioxo-3-thiolanyl)methyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[(1,1-dioxothiolan-3-yl)methyl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[(1,1-diketothiolan-3-yl)methyl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1CNC(=O)C2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1CS(=O)(=O)CC1CNC(=O)C2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C16H19N3O3S/c20-16(17-10-14-6-9-23(21,22)12-14)15-4-2-13(3-5-15)11-19-8-1-7-18-19/h1-5,7-8,14H,6,9-12H2,(H,17,20)