6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridine-2-carbothioic S-acid

Systemtic Name: 6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridine-2-carbothioic S-acid Openeye Name: 6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]pyridine-2-carbothioic S-acid CAS Name: 6-[[oxo-[(2-pyridin-4-yl-4-thiazolyl)amino]methyl]amino]-2-pyridinecarbothioic S-acid IUPAC Name: 6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridine-2-carbothioic S-acid Traditional Name: 6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]thiopicolinic acid Formula: C15H11N5O2S2 MolecularWeight: 357.41014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)NC(=O)NC2=CSC(=N2)C3=CC=NC=C3)C(=O)S

Isomeric SMILES

C1=CC(=NC(=C1)NC(=O)NC2=CSC(=N2)C3=CC=NC=C3)C(=O)S

InChI

InChI=1S/C15H11N5O2S2/c21-14(23)10-2-1-3-11(17-10)19-15(22)20-12-8-24-13(18-12)9-4-6-16-7-5-9/h1-8H,(H,21,23)(H2,17,19,20,22)