1,1-bis(oxidanylidene)-N-[2-(pyrazol-1-ylmethyl)phenyl]thian-4-amine

Systemtic Name: 1,1-bis(oxidanylidene)-N-[2-(pyrazol-1-ylmethyl)phenyl]thian-4-amine Openeye Name: 1,1-dioxo-N-[2-(pyrazol-1-ylmethyl)phenyl]thian-4-amine CAS Name: 1,1-dioxo-N-[2-(1-pyrazolylmethyl)phenyl]-4-thianamine IUPAC Name: 1,1-dioxo-N-[2-(pyrazol-1-ylmethyl)phenyl]thian-4-amine Traditional Name: (1,1-diketothian-4-yl)-[2-(pyrazol-1-ylmethyl)phenyl]amine Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=CC=CC=C2CN3C=CC=N3

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=CC=CC=C2CN3C=CC=N3

InChI

InChI=1S/C15H19N3O2S/c19-21(20)10-6-14(7-11-21)17-15-5-2-1-4-13(15)12-18-9-3-8-16-18/h1-5,8-9,14,17H,6-7,10-12H2