[(1R)-1-phenylethyl] N-cyano-N'-phenyl-carbamimidothioate

Systemtic Name: [(1R)-1-phenylethyl] N-cyano-N'-phenyl-carbamimidothioate Openeye Name: 1-cyano-3-phenyl-2-[(1R)-1-phenylethyl]isothiourea CAS Name: N-cyano-N'-phenylcarbamimidothioic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] N-cyano-N'-phenylcarbamimidothioate Traditional Name: 1-cyano-3-phenyl-2-[(1R)-1-phenylethyl]isothiourea Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC(=NC2=CC=CC=C2)NC#N

Isomeric SMILES

C[C@H](C1=CC=CC=C1)SC(=NC2=CC=CC=C2)NC#N

InChI

InChI=1S/C16H15N3S/c1-13(14-8-4-2-5-9-14)20-16(18-12-17)19-15-10-6-3-7-11-15/h2-11,13H,1H3,(H,18,19)/t13-/m1/s1