3-methyl-N-[4-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]phenyl]butanamide CAS Name: 3-methyl-N-[4-[1-oxo-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]phenyl]butanamide Traditional Name: N-[4-[2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetyl]phenyl]-3-methyl-butyramide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O3S/c1-4-5-16-11-19(26)23-20(22-16)27-12-17(24)14-6-8-15(9-7-14)21-18(25)10-13(2)3/h6-9,11,13H,4-5,10,12H2,1-3H3,(H,21,25)(H,22,23,26)