methyl 2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethylsulfanylmethanoate

Systemtic Name: methyl 2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethylsulfanylmethanoate Openeye Name: methyl 2-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]ethylsulfanylformate CAS Name: [2-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]ethylthio]formic acid methyl ester IUPAC Name: methyl 2-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]ethylsulfanylformate Traditional Name: [2-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]ethylthio]formic acid methyl ester Formula: C14H18N4O3S MolecularWeight: 322.38272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)SCCN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)SCCN1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C14H18N4O3S/c1-21-14(20)22-9-8-17-6-7-18(13(17)19)11-4-2-10(3-5-11)12(15)16/h2-5H,6-9H2,1H3,(H3,15,16)