N-[(E)-3-(heptyldisulfanyl)-5-oxidanyl-pent-2-en-2-yl]-N-[(2-methyl-6-oxidanylidene-1H-pyrimidin-5-yl)methyl]methanamide

Systemtic Name: N-[(E)-3-(heptyldisulfanyl)-5-oxidanyl-pent-2-en-2-yl]-N-[(2-methyl-6-oxidanylidene-1H-pyrimidin-5-yl)methyl]methanamide Openeye Name: N-[(E)-2-(heptyldisulfanyl)-4-hydroxy-1-methyl-but-1-enyl]-N-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methyl]formamide CAS Name: N-[(E)-3-(heptyldisulfanyl)-5-hydroxypent-2-en-2-yl]-N-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methyl]formamide IUPAC Name: N-[(E)-3-(heptyldisulfanyl)-5-hydroxypent-2-en-2-yl]-N-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methyl]formamide Traditional Name: N-[(E)-2-(heptyldisulfanyl)-4-hydroxy-1-methyl-but-1-enyl]-N-[(6-keto-2-methyl-1H-pyrimidin-5-yl)methyl]formamide Formula: C19H31N3O3S2 MolecularWeight: 413.59774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSSC(=C(C)N(CC1=CN=C(NC1=O)C)C=O)CCO

Isomeric SMILES

CCCCCCCSS/C(=C(\C)/N(CC1=CN=C(NC1=O)C)C=O)/CCO

InChI

InChI=1S/C19H31N3O3S2/c1-4-5-6-7-8-11-26-27-18(9-10-23)15(2)22(14-24)13-17-12-20-16(3)21-19(17)25/h12,14,23H,4-11,13H2,1-3H3,(H,20,21,25)/b18-15+