1,1-bis(oxidanylidene)-N-[(1-phenylpyrazol-4-yl)methyl]thiolan-3-amine

Systemtic Name: 1,1-bis(oxidanylidene)-N-[(1-phenylpyrazol-4-yl)methyl]thiolan-3-amine Openeye Name: 1,1-dioxo-N-[(1-phenylpyrazol-4-yl)methyl]thiolan-3-amine CAS Name: 1,1-dioxo-N-[(1-phenyl-4-pyrazolyl)methyl]-3-thiolanamine IUPAC Name: 1,1-dioxo-N-[(1-phenylpyrazol-4-yl)methyl]thiolan-3-amine Traditional Name: (1,1-diketothiolan-3-yl)-[(1-phenylpyrazol-4-yl)methyl]amine Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CS(=O)(=O)CC1NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C14H17N3O2S/c18-20(19)7-6-13(11-20)15-8-12-9-16-17(10-12)14-4-2-1-3-5-14/h1-5,9-10,13,15H,6-8,11H2