N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-3-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)propionamide Formula: C16H21BrFN3OS MolecularWeight: 402.324843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NC(=S)N1CCC(=O)NC2=C(C=C(C=C2)Br)F)(C)C

Isomeric SMILES

CC1CC(NC(=S)N1CCC(=O)NC2=C(C=C(C=C2)Br)F)(C)C

InChI

InChI=1S/C16H21BrFN3OS/c1-10-9-16(2,3)20-15(23)21(10)7-6-14(22)19-13-5-4-11(17)8-12(13)18/h4-5,8,10H,6-7,9H2,1-3H3,(H,19,22)(H,20,23)