5-ethanoyl-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]pyrrolo[1,2-c]pyrimidine-7-carboxamide

Systemtic Name: 5-ethanoyl-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]pyrrolo[1,2-c]pyrimidine-7-carboxamide Openeye Name: 5-acetyl-3-(2-thienyl)-N-[3-(trifluoromethyl)phenyl]pyrrolo[1,2-c]pyrimidine-7-carboxamide CAS Name: 5-acetyl-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]-7-pyrrolo[1,2-c]pyrimidinecarboxamide IUPAC Name: 5-acetyl-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]pyrrolo[1,2-c]pyrimidine-7-carboxamide Traditional Name: 5-acetyl-3-(2-thienyl)-N-[3-(trifluoromethyl)phenyl]pyrrolo[1,2-c]pyrimidine-7-carboxamide Formula: C21H14F3N3O2S MolecularWeight: 429.41497

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

CC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C21H14F3N3O2S/c1-12(28)15-9-18(20(29)26-14-5-2-4-13(8-14)21(22,23)24)27-11-25-16(10-17(15)27)19-6-3-7-30-19/h2-11H,1H3,(H,26,29)