methyl N'-(1-phenylethyl)-N-[(1S)-1-phenylethyl]carbamimidothioate

Systemtic Name: methyl N'-(1-phenylethyl)-N-[(1S)-1-phenylethyl]carbamimidothioate Openeye Name: 2-methyl-3-(1-phenylethyl)-1-[(1S)-1-phenylethyl]isothiourea CAS Name: N'-(1-phenylethyl)-N-[(1S)-1-phenylethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(1-phenylethyl)-N-[(1S)-1-phenylethyl]carbamimidothioate Traditional Name: 2-methyl-3-(1-phenylethyl)-1-[(1S)-1-phenylethyl]isothiourea Formula: C18H22N2S MolecularWeight: 298.44568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=NC(C)C2=CC=CC=C2)SC

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2S/c1-14(16-10-6-4-7-11-16)19-18(21-3)20-15(2)17-12-8-5-9-13-17/h4-15H,1-3H3,(H,19,20)/t14-,15?/m0/s1