methyl 3-[[N'-[[(2R)-oxolan-2-yl]methyl]carbamimidoyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[N'-[[(2R)-oxolan-2-yl]methyl]carbamimidoyl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[N'-[[(2R)-tetrahydrofuran-2-yl]methyl]carbamimidoyl]sulfanylmethyl]benzoate CAS Name: 3-[[[amino-[[(2R)-2-oxolanyl]methylimino]methyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[N'-[[(2R)-oxolan-2-yl]methyl]carbamimidoyl]sulfanylmethyl]benzoate Traditional Name: 3-[[[N'-[[(2R)-tetrahydrofuran-2-yl]methyl]amidino]thio]methyl]benzoic acid methyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSC(=NCC2CCCO2)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSC(=NC[C@H]2CCCO2)N

InChI

InChI=1S/C15H20N2O3S/c1-19-14(18)12-5-2-4-11(8-12)10-21-15(16)17-9-13-6-3-7-20-13/h2,4-5,8,13H,3,6-7,9-10H2,1H3,(H2,16,17)/t13-/m1/s1