methyl 3-[[N'-[(2R)-1-methoxypropan-2-yl]carbamimidoyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[N'-[(2R)-1-methoxypropan-2-yl]carbamimidoyl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[N'-[(1R)-2-methoxy-1-methyl-ethyl]carbamimidoyl]sulfanylmethyl]benzoate CAS Name: 3-[[[amino-[(2R)-1-methoxypropan-2-yl]iminomethyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[N'-[(2R)-1-methoxypropan-2-yl]carbamimidoyl]sulfanylmethyl]benzoate Traditional Name: 3-[[[N'-[(1R)-2-methoxy-1-methyl-ethyl]amidino]thio]methyl]benzoic acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N=C(N)SCC1=CC=CC(=C1)C(=O)OC

Isomeric SMILES

C[C@H](COC)N=C(N)SCC1=CC=CC(=C1)C(=O)OC

InChI

InChI=1S/C14H20N2O3S/c1-10(8-18-2)16-14(15)20-9-11-5-4-6-12(7-11)13(17)19-3/h4-7,10H,8-9H2,1-3H3,(H2,15,16)/t10-/m1/s1