1,1-bis(oxidanylidene)-N-[3-(1H-pyrazol-5-yl)phenyl]thian-4-amine

Systemtic Name: 1,1-bis(oxidanylidene)-N-[3-(1H-pyrazol-5-yl)phenyl]thian-4-amine Openeye Name: 1,1-dioxo-N-[3-(1H-pyrazol-5-yl)phenyl]thian-4-amine CAS Name: 1,1-dioxo-N-[3-(1H-pyrazol-5-yl)phenyl]-4-thianamine IUPAC Name: 1,1-dioxo-N-[3-(1H-pyrazol-5-yl)phenyl]thian-4-amine Traditional Name: (1,1-diketothian-4-yl)-[3-(1H-pyrazol-5-yl)phenyl]amine Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)C3=CC=NN3

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)C3=CC=NN3

InChI

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