O-(N'-butylcarbamimidoyl) N-phenylcarbamothioate

Systemtic Name: O-(N'-butylcarbamimidoyl) N-phenylcarbamothioate Openeye Name: O-(N'-butylcarbamimidoyl) N-phenylcarbamothioate CAS Name: N-phenylcarbamothioic acid O-[amino(butylimino)methyl] ester IUPAC Name: O-(N'-butylcarbamimidoyl) N-phenylcarbamothioate Traditional Name: N-phenylthiocarbamic acid O-(N'-butylamidino) ester Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(N)OC(=S)NC1=CC=CC=C1

Isomeric SMILES

CCCCN=C(N)OC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C12H17N3OS/c1-2-3-9-14-11(13)16-12(17)15-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H2,13,14)(H,15,17)