4-[2-[4-bromanyl-3-(3-chloranyl-5-cyano-phenoxy)-2-fluoranyl-phenyl]ethanoylamino]-3-chloranyl-N-(2-pyrrolidin-1-ylethyl)benzamide

Systemtic Name: 4-[2-[4-bromanyl-3-(3-chloranyl-5-cyano-phenoxy)-2-fluoranyl-phenyl]ethanoylamino]-3-chloranyl-N-(2-pyrrolidin-1-ylethyl)benzamide Openeye Name: 4-[[2-[4-bromo-3-(3-chloro-5-cyano-phenoxy)-2-fluoro-phenyl]acetyl]amino]-3-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide CAS Name: 4-[[2-[4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]-1-oxoethyl]amino]-3-chloro-N-[2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 4-[[2-[4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl]amino]-3-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 4-[[2-[4-bromo-3-(3-chloro-5-cyano-phenoxy)-2-fluoro-phenyl]acetyl]amino]-3-chloro-N-(2-pyrrolidinoethyl)benzamide Formula: C28H24BrCl2FN4O3 MolecularWeight: 634.323563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(=O)C2=CC(=C(C=C2)NC(=O)CC3=C(C(=C(C=C3)Br)OC4=CC(=CC(=C4)C#N)Cl)F)Cl

Isomeric SMILES

C1CCN(C1)CCNC(=O)C2=CC(=C(C=C2)NC(=O)CC3=C(C(=C(C=C3)Br)OC4=CC(=CC(=C4)C#N)Cl)F)Cl

InChI

InChI=1S/C28H24BrCl2FN4O3/c29-22-5-3-18(26(32)27(22)39-21-12-17(16-33)11-20(30)15-21)14-25(37)35-24-6-4-19(13-23(24)31)28(38)34-7-10-36-8-1-2-9-36/h3-6,11-13,15H,1-2,7-10,14H2,(H,34,38)(H,35,37)