3-oxidanylidenepropyl N,N'-bis(azanyl)-N-methyl-carbamimidothioate

Systemtic Name: 3-oxidanylidenepropyl N,N'-bis(azanyl)-N-methyl-carbamimidothioate Openeye Name: 1,3-diamino-1-methyl-2-(3-oxopropyl)isothiourea CAS Name: N,N'-diamino-N-methylcarbamimidothioic acid 3-oxopropyl ester IUPAC Name: 3-oxopropyl N,N'-diamino-N-methylcarbamimidothioate Traditional Name: 1,3-diamino-2-(3-ketopropyl)-1-methyl-isothiourea Formula: C5H12N4OS MolecularWeight: 176.23998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=NN)SCCC=O)N

Isomeric SMILES

CN(/C(=N/N)/SCCC=O)N

InChI

InChI=1S/C5H12N4OS/c1-9(7)5(8-6)11-4-2-3-10/h3H,2,4,6-7H2,1H3/b8-5-