2-(1-phenylethylsulfonyl)ethyl carbamimidothioate

Systemtic Name: 2-(1-phenylethylsulfonyl)ethyl carbamimidothioate Openeye Name: 2-[2-(1-phenylethylsulfonyl)ethyl]isothiourea CAS Name: carbamimidothioic acid 2-(1-phenylethylsulfonyl)ethyl ester IUPAC Name: 2-(1-phenylethylsulfonyl)ethyl carbamimidothioate Traditional Name: 2-[2-(1-phenylethylsulfonyl)ethyl]isothiourea Formula: C11H16N2O2S2 MolecularWeight: 272.38694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)S(=O)(=O)CCSC(=N)N

Isomeric SMILES

CC(C1=CC=CC=C1)S(=O)(=O)CCSC(=N)N

InChI

InChI=1S/C11H16N2O2S2/c1-9(10-5-3-2-4-6-10)17(14,15)8-7-16-11(12)13/h2-6,9H,7-8H2,1H3,(H3,12,13)