(5S)-1-propan-2-yl-5-(pyridin-3-ylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-1-propan-2-yl-5-(pyridin-3-ylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-1-isopropyl-5-(3-pyridylmethyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-1-propan-2-yl-5-(3-pyridinylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-1-propan-2-yl-5-(pyridin-3-ylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-1-isopropyl-5-(3-pyridylmethyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(C(=O)NC1=S)C=NCC2=CN=CC=C2

Isomeric SMILES

CC(C)N1C(=O)[C@H](C(=O)NC1=S)C=NCC2=CN=CC=C2

InChI

InChI=1S/C14H16N4O2S/c1-9(2)18-13(20)11(12(19)17-14(18)21)8-16-7-10-4-3-5-15-6-10/h3-6,8-9,11H,7H2,1-2H3,(H,17,19,21)/t11-/m0/s1