[(R)-(4-chlorophenyl)-phenyl-methyl] N'-(4-ethoxyphenyl)carbamimidothioate

Systemtic Name: [(R)-(4-chlorophenyl)-phenyl-methyl] N'-(4-ethoxyphenyl)carbamimidothioate Openeye Name: 2-[(R)-(4-chlorophenyl)-phenyl-methyl]-3-(4-ethoxyphenyl)isothiourea CAS Name: N'-(4-ethoxyphenyl)carbamimidothioic acid [(R)-(4-chlorophenyl)-phenylmethyl] ester IUPAC Name: [(R)-(4-chlorophenyl)-phenylmethyl] N'-(4-ethoxyphenyl)carbamimidothioate Traditional Name: 2-[(R)-(4-chlorophenyl)-phenyl-methyl]-3-p-phenetyl-isothiourea Formula: C22H21ClN2OS MolecularWeight: 396.93294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C(N)SC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C(N)S[C@H](C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H21ClN2OS/c1-2-26-20-14-12-19(13-15-20)25-22(24)27-21(16-6-4-3-5-7-16)17-8-10-18(23)11-9-17/h3-15,21H,2H2,1H3,(H2,24,25)/t21-/m1/s1