2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-piperidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-piperidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide CAS Name: N-[4-[oxo(1-piperidinyl)methyl]phenyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide 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=C(C=C2)C(=O)N3CCCCC3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C21H26N4O3S/c1-2-6-17-13-18(26)24-21(23-17)29-14-19(27)22-16-9-7-15(8-10-16)20(28)25-11-4-3-5-12-25/h7-10,13H,2-6,11-12,14H2,1H3,(H,22,27)(H,23,24,26)