5-(2-dimethylaminoethyliminomethyl)-1-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(2-dimethylaminoethyliminomethyl)-1-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(2-dimethylaminoethyliminomethyl)-1-[(4-fluorophenyl)methyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(2-dimethylaminoethyliminomethyl)-1-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(2-dimethylaminoethyliminomethyl)-1-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(2-dimethylaminoethyliminomethyl)-1-(4-fluorobenzyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H19FN4O2S MolecularWeight: 350.411063

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN=CC1C(=O)NC(=S)N(C1=O)CC2=CC=C(C=C2)F

Isomeric SMILES

CN(C)CCN=CC1C(=O)NC(=S)N(C1=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN4O2S/c1-20(2)8-7-18-9-13-14(22)19-16(24)21(15(13)23)10-11-3-5-12(17)6-4-11/h3-6,9,13H,7-8,10H2,1-2H3,(H,19,22,24)