[(3R)-3-phenylbutyl] carbamimidothioate

Systemtic Name: [(3R)-3-phenylbutyl] carbamimidothioate Openeye Name: 2-[(3R)-3-phenylbutyl]isothiourea CAS Name: carbamimidothioic acid [(3R)-3-phenylbutyl] ester IUPAC Name: [(3R)-3-phenylbutyl] carbamimidothioate Traditional Name: 2-[(3R)-3-phenylbutyl]isothiourea Formula: C11H16N2S MolecularWeight: 208.32314

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCSC(=N)N)C1=CC=CC=C1

Isomeric SMILES

C[C@H](CCSC(=N)N)C1=CC=CC=C1

InChI

InChI=1S/C11H16N2S/c1-9(7-8-14-11(12)13)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H3,12,13)/t9-/m1/s1