(5-ethanoyl-2-ethoxy-phenyl)methyl N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioate Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methyl]-3-[(1R)-2-methoxy-1-methyl-ethyl]isothiourea CAS Name: N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioate Traditional Name: 2-(5-acetyl-2-ethoxy-benzyl)-3-[(1R)-2-methoxy-1-methyl-ethyl]isothiourea Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC(=NC(C)COC)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC(=N[C@H](C)COC)N

InChI

InChI=1S/C16H24N2O3S/c1-5-21-15-7-6-13(12(3)19)8-14(15)10-22-16(17)18-11(2)9-20-4/h6-8,11H,5,9-10H2,1-4H3,(H2,17,18)/t11-/m1/s1