N-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-N-[(E)-4-oxidanyl-2-(oxolan-2-ylmethyldisulfanyl)but-1-enyl]methanamide

Systemtic Name: N-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-N-[(E)-4-oxidanyl-2-(oxolan-2-ylmethyldisulfanyl)but-1-enyl]methanamide Openeye Name: N-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-N-[(E)-4-hydroxy-2-(tetrahydrofuran-2-ylmethyldisulfanyl)but-1-enyl]formamide CAS Name: N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-[(E)-4-hydroxy-2-(2-oxolanylmethyldisulfanyl)but-1-enyl]formamide IUPAC Name: N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[(E)-4-hydroxy-2-(oxolan-2-ylmethyldisulfanyl)but-1-enyl]formamide Traditional Name: N-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-N-[(E)-4-hydroxy-2-(tetrahydrofurfuryldisulfanyl)but-1-enyl]formamide Formula: C16H24N4O3S2 MolecularWeight: 384.51676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N)CN(C=C(CCO)SSCC2CCCO2)C=O

Isomeric SMILES

CC1=NC=C(C(=N1)N)CN(/C=C(\CCO)/SSCC2CCCO2)C=O

InChI

InChI=1S/C16H24N4O3S2/c1-12-18-7-13(16(17)19-12)8-20(11-22)9-15(4-5-21)25-24-10-14-3-2-6-23-14/h7,9,11,14,21H,2-6,8,10H2,1H3,(H2,17,18,19)/b15-9+