1-[5-(6,7-dimethoxyquinolin-4-yl)sulfanylthiophen-2-yl]-3-(3-fluorophenyl)urea

Systemtic Name: 1-[5-(6,7-dimethoxyquinolin-4-yl)sulfanylthiophen-2-yl]-3-(3-fluorophenyl)urea Openeye Name: 1-[5-[(6,7-dimethoxy-4-quinolyl)sulfanyl]-2-thienyl]-3-(3-fluorophenyl)urea CAS Name: 1-[5-[(6,7-dimethoxy-4-quinolinyl)thio]-2-thiophenyl]-3-(3-fluorophenyl)urea IUPAC Name: 1-[5-(6,7-dimethoxyquinolin-4-yl)sulfanylthiophen-2-yl]-3-(3-fluorophenyl)urea Traditional Name: 1-[5-[(6,7-dimethoxy-4-quinolyl)thio]-2-thienyl]-3-(3-fluorophenyl)urea Formula: C22H18FN3O3S2 MolecularWeight: 455.525023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)SC3=CC=C(S3)NC(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)SC3=CC=C(S3)NC(=O)NC4=CC(=CC=C4)F

InChI

InChI=1S/C22H18FN3O3S2/c1-28-17-11-15-16(12-18(17)29-2)24-9-8-19(15)30-21-7-6-20(31-21)26-22(27)25-14-5-3-4-13(23)10-14/h3-12H,1-2H3,(H2,25,26,27)