N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]naphthalen-1-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]naphthalen-1-yl]-2-fluoranyl-benzamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-1-naphthyl]-2-fluoro-benzamide CAS Name: N-[4-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-1-naphthalenyl]-2-fluorobenzamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]naphthalen-1-yl]-2-fluorobenzamide Traditional Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-1-naphthyl]-2-fluoro-benzamide Formula: C26H21ClFN3O3S MolecularWeight: 509.979643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C3=CC=CC=C32)NC(=O)C4=CC=CC=C4F)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C3=CC=CC=C32)NC(=O)C4=CC=CC=C4F)Cl)OC

InChI

InChI=1S/C26H21ClFN3O3S/c1-33-23-14-24(34-2)22(13-18(23)27)31-26(35)30-21-12-11-20(15-7-3-4-8-16(15)21)29-25(32)17-9-5-6-10-19(17)28/h3-14H,1-2H3,(H,29,32)(H2,30,31,35)