2-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]phenyl]sulfanylethanoic acid Openeye Name: 2-[4-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]phenyl]sulfanylacetic acid CAS Name: 2-[[4-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]phenyl]thio]acetic acid IUPAC Name: 2-[4-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]phenyl]sulfanylacetic acid Traditional Name: 2-[[4-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]phenyl]thio]acetic acid Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1C2=CC=C(C=C2)C(=N)N)C3=CC=C(C=C3)SCC(=O)O

Isomeric SMILES

C1CN(C(=O)N1C2=CC=C(C=C2)C(=N)N)C3=CC=C(C=C3)SCC(=O)O

InChI

InChI=1S/C18H18N4O3S/c19-17(20)12-1-3-13(4-2-12)21-9-10-22(18(21)25)14-5-7-15(8-6-14)26-11-16(23)24/h1-8H,9-11H2,(H3,19,20)(H,23,24)