N-(4-bromanyl-2-fluoranyl-phenyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-bromo-2-fluoro-phenyl)propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(4-bromo-2-fluoro-phenyl)propionamide Formula: C18H15BrFN3O2S2 MolecularWeight: 468.363003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=NC3=C(C=CS3)C(=O)N2CC=C

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=NC3=C(C=CS3)C(=O)N2CC=C

InChI

InChI=1S/C18H15BrFN3O2S2/c1-3-7-23-17(25)12-6-8-26-16(12)22-18(23)27-10(2)15(24)21-14-5-4-11(19)9-13(14)20/h3-6,8-10H,1,7H2,2H3,(H,21,24)