1,1-bis(oxidanylidene)-N-(3-pyrazol-1-ylphenyl)thian-4-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)N3C=CC=N3

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)N3C=CC=N3

InChI

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