N-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]benzamide

Systemtic Name: N-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]benzamide Openeye Name: N-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]benzamide CAS Name: N-[1-oxo-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]benzamide IUPAC Name: N-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]benzamide Traditional Name: N-[2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetyl]benzamide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H17N3O3S/c1-2-6-12-9-13(20)19-16(17-12)23-10-14(21)18-15(22)11-7-4-3-5-8-11/h3-5,7-9H,2,6,10H2,1H3,(H,17,19,20)(H,18,21,22)