2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-propyl-ethanamide

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-propyl-ethanamide Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-(1,1-dioxothiolan-3-yl)-N-propyl-acetamide CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-(1,1-dioxo-3-thiolanyl)-N-propylacetamide IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(1,1-dioxothiolan-3-yl)-N-propylacetamide Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-(1,1-diketothiolan-3-yl)-N-propyl-acetamide Formula: C14H22N4O3S2 MolecularWeight: 358.47948

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC(=CC(=N2)N)C

Isomeric SMILES

CCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC(=CC(=N2)N)C

InChI

InChI=1S/C14H22N4O3S2/c1-3-5-18(11-4-6-23(20,21)9-11)13(19)8-22-14-16-10(2)7-12(15)17-14/h7,11H,3-6,8-9H2,1-2H3,(H2,15,16,17)