methyl 2-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]sulfanylethanoate

Systemtic Name: methyl 2-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]sulfanylethanoate Openeye Name: methyl 2-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]sulfanylacetate CAS Name: 2-[[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]sulfanylacetate Traditional Name: 2-[[4-[5-(4-amidinophenyl)-1H-imidazol-2-yl]phenyl]thio]acetic acid methyl ester Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=CC=C(C=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CSC1=CC=C(C=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H18N4O2S/c1-25-17(24)11-26-15-8-6-14(7-9-15)19-22-10-16(23-19)12-2-4-13(5-3-12)18(20)21/h2-10H,11H2,1H3,(H3,20,21)(H,22,23)