4-[2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 4-[[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 4-[[2-[(5-ethyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]acetyl]amino]benzamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=O)NC2=CC=C(C=C2)C(=O)N)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(=O)NC2=CC=C(C=C2)C(=O)N)C

InChI

InChI=1S/C16H18N4O3S/c1-3-12-9(2)18-16(20-15(12)23)24-8-13(21)19-11-6-4-10(5-7-11)14(17)22/h4-7H,3,8H2,1-2H3,(H2,17,22)(H,19,21)(H,18,20,23)