1-bis[(methylcarbamothioylamino)carbamoylamino]phosphoryl-3-(methylcarbamothioylamino)urea

Systemtic Name: 1-bis[(methylcarbamothioylamino)carbamoylamino]phosphoryl-3-(methylcarbamothioylamino)urea Openeye Name: 1-bis[(methylcarbamothioylamino)carbamoylamino]phosphoryl-3-(methylcarbamothioylamino)urea CAS Name: 1-bis[[[[methylamino(sulfanylidene)methyl]hydrazo]-oxomethyl]amino]phosphoryl-3-[[methylamino(sulfanylidene)methyl]amino]urea IUPAC Name: 1-bis[(methylcarbamothioylamino)carbamoylamino]phosphoryl-3-(methylcarbamothioylamino)urea Traditional Name: 1-bis[(methylthiocarbamoylamino)carbamoylamino]phosphoryl-3-(methylthiocarbamoylamino)urea Formula: C9H21N12O4PS3 MolecularWeight: 488.509801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)NP(=O)(NC(=O)NNC(=S)NC)NC(=O)NNC(=S)NC

Isomeric SMILES

CNC(=S)NNC(=O)NP(=O)(NC(=O)NNC(=S)NC)NC(=O)NNC(=S)NC

InChI

InChI=1S/C9H21N12O4PS3/c1-10-7(27)16-13-4(22)19-26(25,20-5(23)14-17-8(28)11-2)21-6(24)15-18-9(29)12-3/h1-3H3,(H2,10,16,27)(H2,11,17,28)(H2,12,18,29)(H6,13,14,15,19,20,21,22,23,24,25)