5-[3-[(3S)-heptan-3-yl]oxypropyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[3-[(3S)-heptan-3-yl]oxypropyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[3-[(1S)-1-ethylpentoxy]propyliminomethyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[3-[(3S)-heptan-3-yl]oxypropyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[3-[(3S)-heptan-3-yl]oxypropyliminomethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[3-[(1S)-1-ethylpentoxy]propyliminomethyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H25N3O3S MolecularWeight: 327.4423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)OCCCN=CC1C(=O)NC(=S)NC1=O

Isomeric SMILES

CCCC[C@H](CC)OCCCN=CC1C(=O)NC(=S)NC1=O

InChI

InChI=1S/C15H25N3O3S/c1-3-5-7-11(4-2)21-9-6-8-16-10-12-13(19)17-15(22)18-14(12)20/h10-12H,3-9H2,1-2H3,(H2,17,18,19,20,22)/t11-/m0/s1