6-azanyl-1-(2-methylpropyl)-5-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-(2-methylpropyl)-5-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-5-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-(2-methylpropyl)-5-[1-oxo-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-(2-methylpropyl)-5-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-5-[2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetyl]pyrimidine-2,4-quinone Formula: C17H23N5O4S MolecularWeight: 393.46062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5O4S/c1-4-5-10-6-12(24)20-16(19-10)27-8-11(23)13-14(18)22(7-9(2)3)17(26)21-15(13)25/h6,9H,4-5,7-8,18H2,1-3H3,(H,19,20,24)(H,21,25,26)