(5S)-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-1-allyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-5-[3-(4-morpholin-4-iumyl)propyliminomethyl]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-1-allyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H23N4O3S+ MolecularWeight: 339.43312

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(C(=O)NC1=S)C=NCCC[NH+]2CCOCC2

Isomeric SMILES

C=CCN1C(=O)[C@H](C(=O)NC1=S)C=NCCC[NH+]2CCOCC2

InChI

InChI=1S/C15H22N4O3S/c1-2-5-19-14(21)12(13(20)17-15(19)23)11-16-4-3-6-18-7-9-22-10-8-18/h2,11-12H,1,3-10H2,(H,17,20,23)/p+1/t12-/m0/s1