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

Systemtic Name: 1-[(3S)-1-bromanylnonan-3-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-[(1S)-1-(2-bromoethyl)heptyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-[(3S)-1-bromononan-3-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-[(3S)-1-bromononan-3-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-[(1S)-1-(2-bromoethyl)heptyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H21BrN2O2S MolecularWeight: 349.28704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCBr)N1C(=O)CC(=O)NC1=S

Isomeric SMILES

CCCCCC[C@@H](CCBr)N1C(=O)CC(=O)NC1=S

InChI

InChI=1S/C13H21BrN2O2S/c1-2-3-4-5-6-10(7-8-14)16-12(18)9-11(17)15-13(16)19/h10H,2-9H2,1H3,(H,15,17,19)/t10-/m0/s1