1-[6-fluoranyl-1-(thiophen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-3-isoquinolin-5-yl-urea

Systemtic Name: 1-[6-fluoranyl-1-(thiophen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-3-isoquinolin-5-yl-urea Openeye Name: 1-[6-fluoro-1-(2-thienylmethyl)tetralin-2-yl]-3-(5-isoquinolyl)urea CAS Name: 1-[6-fluoro-1-(thiophen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-3-(5-isoquinolinyl)urea IUPAC Name: 1-[6-fluoro-1-(thiophen-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-3-isoquinolin-5-ylurea Traditional Name: 1-[6-fluoro-1-(2-thenyl)tetralin-2-yl]-3-(5-isoquinolyl)urea Formula: C25H22FN3OS MolecularWeight: 431.525083

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)F)C(C1NC(=O)NC3=CC=CC4=C3C=CN=C4)CC5=CC=CS5

Isomeric SMILES

C1CC2=C(C=CC(=C2)F)C(C1NC(=O)NC3=CC=CC4=C3C=CN=C4)CC5=CC=CS5

InChI

InChI=1S/C25H22FN3OS/c26-18-7-8-20-16(13-18)6-9-24(22(20)14-19-4-2-12-31-19)29-25(30)28-23-5-1-3-17-15-27-11-10-21(17)23/h1-5,7-8,10-13,15,22,24H,6,9,14H2,(H2,28,29,30)