1-[3-(benzimidazol-1-yl)propyl]-3-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)urea

Systemtic Name: 1-[3-(benzimidazol-1-yl)propyl]-3-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)urea Openeye Name: 1-[3-(benzimidazol-1-yl)propyl]-3-(6-fluorothiochroman-4-yl)urea CAS Name: 1-[3-(1-benzimidazolyl)propyl]-3-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)urea IUPAC Name: 1-[3-(benzimidazol-1-yl)propyl]-3-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)urea Traditional Name: 1-[3-(benzimidazol-1-yl)propyl]-3-(6-fluorothiochroman-4-yl)urea Formula: C20H21FN4OS MolecularWeight: 384.470343

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)NCCCN3C=NC4=CC=CC=C43)C=C(C=C2)F

Isomeric SMILES

C1CSC2=C(C1NC(=O)NCCCN3C=NC4=CC=CC=C43)C=C(C=C2)F

InChI

InChI=1S/C20H21FN4OS/c21-14-6-7-19-15(12-14)16(8-11-27-19)24-20(26)22-9-3-10-25-13-23-17-4-1-2-5-18(17)25/h1-2,4-7,12-13,16H,3,8-11H2,(H2,22,24,26)