7-[2-(2-fluorophenyl)ethanoylamino]-N-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 7-[2-(2-fluorophenyl)ethanoylamino]-N-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 7-[[2-(2-fluorophenyl)acetyl]amino]-N-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 7-[[2-(2-fluorophenyl)-1-oxoethyl]amino]-N-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 7-[[2-(2-fluorophenyl)acetyl]amino]-N-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 7-[[2-(2-fluorophenyl)acetyl]amino]-N-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C22H20FN3O2S MolecularWeight: 409.476503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)CC3=CC=CC=C3F)C(=O)NC4=CC=CS4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)CC3=CC=CC=C3F)C(=O)NC4=CC=CS4

InChI

InChI=1S/C22H20FN3O2S/c23-19-5-2-1-4-16(19)13-20(27)24-18-8-7-15-9-10-26(14-17(15)12-18)22(28)25-21-6-3-11-29-21/h1-8,11-12H,9-10,13-14H2,(H,24,27)(H,25,28)