2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]benzamide CAS Name: 2-[[2-[(4,6-diamino-2-pyrimidinyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: 2-[[2-[(4,6-diaminopyrimidin-2-yl)thio]acetyl]amino]benzamide Formula: C13H14N6O2S MolecularWeight: 318.35426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N)NC(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N)NC(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C13H14N6O2S/c14-9-5-10(15)19-13(18-9)22-6-11(20)17-8-4-2-1-3-7(8)12(16)21/h1-5H,6H2,(H2,16,21)(H,17,20)(H4,14,15,18,19)