6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-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-3-methyl-5-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-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-3-methyl-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]-3-methyl-pyrimidine-2,4-quinone Formula: C18H25N5O4S MolecularWeight: 407.4872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O4S/c1-5-6-11-7-13(25)21-17(20-11)28-9-12(24)14-15(19)23(8-10(2)3)18(27)22(4)16(14)26/h7,10H,5-6,8-9,19H2,1-4H3,(H,20,21,25)