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

Systemtic Name: N-cyclopentyl-2-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-cyclopentyl-2-[[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-cyclopentyl-2-[[1-oxo-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]amino]benzamide IUPAC Name: N-cyclopentyl-2-[[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-cyclopentyl-2-[[2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetyl]amino]benzamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3

InChI

InChI=1S/C21H26N4O3S/c1-2-7-15-12-18(26)25-21(23-15)29-13-19(27)24-17-11-6-5-10-16(17)20(28)22-14-8-3-4-9-14/h5-6,10-12,14H,2-4,7-9,13H2,1H3,(H,22,28)(H,24,27)(H,23,25,26)