2-(2-fluorophenyl)-N-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide

Systemtic Name: 2-(2-fluorophenyl)-N-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide Openeye Name: 2-(2-fluorophenyl)-N-[2-[(E)-3-(2-thienyl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetamide CAS Name: 2-(2-fluorophenyl)-N-[2-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetamide IUPAC Name: 2-(2-fluorophenyl)-N-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Traditional Name: 2-(2-fluorophenyl)-N-[2-[(E)-3-(2-thienyl)acryloyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Formula: C24H21FN2O2S MolecularWeight: 420.499143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)CC3=CC=CC=C3F)C(=O)C=CC4=CC=CS4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)CC3=CC=CC=C3F)C(=O)/C=C/C4=CC=CS4

InChI

InChI=1S/C24H21FN2O2S/c25-22-6-2-1-4-18(22)15-23(28)26-20-8-7-17-11-12-27(16-19(17)14-20)24(29)10-9-21-5-3-13-30-21/h1-10,13-14H,11-12,15-16H2,(H,26,28)/b10-9+