2-[[(Z)-N'-(pyridin-4-ylcarbonylamino)carbamimidoyl]amino]sulfanylethanoic acid

Systemtic Name: 2-[[(Z)-N'-(pyridin-4-ylcarbonylamino)carbamimidoyl]amino]sulfanylethanoic acid Openeye Name: 2-[[(Z)-N'-(pyridine-4-carbonylamino)carbamimidoyl]amino]sulfanylacetic acid CAS Name: 2-[[[(Z)-amino-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]methyl]amino]thio]acetic acid IUPAC Name: 2-[[(Z)-N'-(pyridine-4-carbonylamino)carbamimidoyl]amino]sulfanylacetic acid Traditional Name: 2-[[[(Z)-N'-isonicotinamidoamidino]amino]thio]acetic acid Formula: C9H11N5O3S MolecularWeight: 269.28034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C(=O)NN=C(N)NSCC(=O)O

Isomeric SMILES

C1=CN=CC=C1C(=O)N/N=C(/N)\NSCC(=O)O

InChI

InChI=1S/C9H11N5O3S/c10-9(14-18-5-7(15)16)13-12-8(17)6-1-3-11-4-2-6/h1-4H,5H2,(H,12,17)(H,15,16)(H3,10,13,14)