N-[4-azanyl-6-oxidanylidene-5-(phenylmethyl)-2-sulfanylidene-pyrimidin-5-yl]ethanamide

Systemtic Name: N-[4-azanyl-6-oxidanylidene-5-(phenylmethyl)-2-sulfanylidene-pyrimidin-5-yl]ethanamide Openeye Name: N-(4-amino-5-benzyl-6-oxo-2-thioxo-pyrimidin-5-yl)acetamide CAS Name: N-[4-amino-6-oxo-5-(phenylmethyl)-2-sulfanylidene-5-pyrimidinyl]acetamide IUPAC Name: N-(4-amino-5-benzyl-6-oxo-2-sulfanylidenepyrimidin-5-yl)acetamide Traditional Name: N-(4-amino-5-benzyl-6-keto-2-thioxo-pyrimidin-5-yl)acetamide Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C(=NC(=S)NC1=O)N)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1(C(=NC(=S)NC1=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C13H14N4O2S/c1-8(18)17-13(7-9-5-3-2-4-6-9)10(14)15-12(20)16-11(13)19/h2-6H,7H2,1H3,(H,17,18)(H3,14,15,16,19,20)