methyl N'-methyl-N-[3-(1,3-oxazol-2-ylsulfanyl)propyl]carbamimidothioate

Systemtic Name: methyl N'-methyl-N-[3-(1,3-oxazol-2-ylsulfanyl)propyl]carbamimidothioate Openeye Name: 2,3-dimethyl-1-(3-oxazol-2-ylsulfanylpropyl)isothiourea CAS Name: N'-methyl-N-[3-(2-oxazolylthio)propyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-methyl-N-[3-(1,3-oxazol-2-ylsulfanyl)propyl]carbamimidothioate Traditional Name: 2,3-dimethyl-1-[3-(oxazol-2-ylthio)propyl]isothiourea Formula: C9H15N3OS2 MolecularWeight: 245.3649

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCCSC1=NC=CO1)SC

Isomeric SMILES

CN=C(NCCCSC1=NC=CO1)SC

InChI

InChI=1S/C9H15N3OS2/c1-10-8(14-2)11-4-3-7-15-9-12-5-6-13-9/h5-6H,3-4,7H2,1-2H3,(H,10,11)