2-[2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 2-[[2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]acetyl]amino]benzamide Formula: C13H13N5O3S MolecularWeight: 319.33902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N5O3S/c14-9-5-10(19)18-13(17-9)22-6-11(20)16-8-4-2-1-3-7(8)12(15)21/h1-5H,6H2,(H2,15,21)(H,16,20)(H3,14,17,18,19)