1-azanyl-N-(4-fluorophenyl)-5-thiophen-2-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide

Systemtic Name: 1-azanyl-N-(4-fluorophenyl)-5-thiophen-2-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Openeye Name: 1-amino-N-(4-fluorophenyl)-5-(2-thienyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide CAS Name: 1-amino-N-(4-fluorophenyl)-5-thiophen-2-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide IUPAC Name: 1-amino-N-(4-fluorophenyl)-5-thiophen-2-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Traditional Name: 1-amino-N-(4-fluorophenyl)-5-(2-thienyl)-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxamide Formula: C22H18FN3OS2 MolecularWeight: 423.526223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C3C(=C2C1)C(=C(S3)C(=O)NC4=CC=C(C=C4)F)N)C5=CC=CS5

Isomeric SMILES

C1CCC2=C(N=C3C(=C2C1)C(=C(S3)C(=O)NC4=CC=C(C=C4)F)N)C5=CC=CS5

InChI

InChI=1S/C22H18FN3OS2/c23-12-7-9-13(10-8-12)25-21(27)20-18(24)17-14-4-1-2-5-15(14)19(26-22(17)29-20)16-6-3-11-28-16/h3,6-11H,1-2,4-5,24H2,(H,25,27)