1,1-bis(oxidanylidene)-N-[3-(1,2,4-triazol-4-yl)phenyl]thian-4-amine

Systemtic Name: 1,1-bis(oxidanylidene)-N-[3-(1,2,4-triazol-4-yl)phenyl]thian-4-amine Openeye Name: 1,1-dioxo-N-[3-(1,2,4-triazol-4-yl)phenyl]thian-4-amine CAS Name: 1,1-dioxo-N-[3-(1,2,4-triazol-4-yl)phenyl]-4-thianamine IUPAC Name: 1,1-dioxo-N-[3-(1,2,4-triazol-4-yl)phenyl]thian-4-amine Traditional Name: (1,1-diketothian-4-yl)-[3-(1,2,4-triazol-4-yl)phenyl]amine Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)N3C=NN=C3

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=CC=CC(=C2)N3C=NN=C3

InChI

InChI=1S/C13H16N4O2S/c18-20(19)6-4-11(5-7-20)16-12-2-1-3-13(8-12)17-9-14-15-10-17/h1-3,8-11,16H,4-7H2