(4-cyanophenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate

Systemtic Name: (4-cyanophenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate Openeye Name: 2-[(4-cyanophenyl)methyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiourea CAS Name: N'-[[(2R)-2-oxolanyl]methyl]carbamimidothioic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate Traditional Name: 2-(4-cyanobenzyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiourea Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN=C(N)SCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1C[C@@H](OC1)CN=C(N)SCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H17N3OS/c15-8-11-3-5-12(6-4-11)10-19-14(16)17-9-13-2-1-7-18-13/h3-6,13H,1-2,7,9-10H2,(H2,16,17)/t13-/m1/s1