3-[(3-chloranyl-4-propoxy-phenyl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide

Systemtic Name: 3-[(3-chloranyl-4-propoxy-phenyl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide Openeye Name: 3-[(3-chloro-4-propoxy-phenyl)sulfanylcarbamoylamino]-2-fluoro-4-phenyl-benzamide CAS Name: 3-[[[[(3-chloro-4-propoxyphenyl)thio]amino]-oxomethyl]amino]-2-fluoro-4-phenylbenzamide IUPAC Name: 3-[(3-chloro-4-propoxyphenyl)sulfanylcarbamoylamino]-2-fluoro-4-phenylbenzamide Traditional Name: 3-[[(3-chloro-4-propoxy-phenyl)thio]carbamoylamino]-2-fluoro-4-phenyl-benzamide Formula: C23H21ClFN3O3S MolecularWeight: 473.947543

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCOC1=C(C=C(C=C1)SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3)Cl

InChI

InChI=1S/C23H21ClFN3O3S/c1-2-12-31-19-11-8-15(13-18(19)24)32-28-23(30)27-21-16(14-6-4-3-5-7-14)9-10-17(20(21)25)22(26)29/h3-11,13H,2,12H2,1H3,(H2,26,29)(H2,27,28,30)