3-[(3-bromanyl-4-methoxy-phenyl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide

Systemtic Name: 3-[(3-bromanyl-4-methoxy-phenyl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide Openeye Name: 3-[(3-bromo-4-methoxy-phenyl)sulfanylcarbamoylamino]-2-fluoro-4-phenyl-benzamide CAS Name: 3-[[[[(3-bromo-4-methoxyphenyl)thio]amino]-oxomethyl]amino]-2-fluoro-4-phenylbenzamide IUPAC Name: 3-[(3-bromo-4-methoxyphenyl)sulfanylcarbamoylamino]-2-fluoro-4-phenylbenzamide Traditional Name: 3-[[(3-bromo-4-methoxy-phenyl)thio]carbamoylamino]-2-fluoro-4-phenyl-benzamide Formula: C21H17BrFN3O3S MolecularWeight: 490.345383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3)Br

InChI

InChI=1S/C21H17BrFN3O3S/c1-29-17-10-7-13(11-16(17)22)30-26-21(28)25-19-14(12-5-3-2-4-6-12)8-9-15(18(19)23)20(24)27/h2-11H,1H3,(H2,24,27)(H2,25,26,28)