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

Systemtic Name: 2-[2-[(5-cyano-6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 2-[[2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[(5-cyano-6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]acetyl]amino]benzamide Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=CC=C2C(=O)N)C#N

Isomeric SMILES

CCC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=CC=C2C(=O)N)C#N

InChI

InChI=1S/C16H15N5O3S/c1-2-11-10(7-17)15(24)21-16(20-11)25-8-13(22)19-12-6-4-3-5-9(12)14(18)23/h3-6H,2,8H2,1H3,(H2,18,23)(H,19,22)(H,20,21,24)