3-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]indol-3-yl]-2-cyano-prop-2-enethioamide

Systemtic Name: 3-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]indol-3-yl]-2-cyano-prop-2-enethioamide Openeye Name: 3-[1-[(2-chloro-6-fluoro-phenyl)methyl]indol-3-yl]-2-cyano-prop-2-enethioamide CAS Name: 3-[1-[(2-chloro-6-fluorophenyl)methyl]-3-indolyl]-2-cyano-2-propenethioamide IUPAC Name: 3-[1-[(2-chloro-6-fluorophenyl)methyl]indol-3-yl]-2-cyanoprop-2-enethioamide Traditional Name: 3-[1-(2-chloro-6-fluoro-benzyl)indol-3-yl]-2-cyano-thioacrylamide Formula: C19H13ClFN3S MolecularWeight: 369.843023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=C(C=CC=C3Cl)F)C=C(C#N)C(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=C(C=CC=C3Cl)F)C=C(C#N)C(=S)N

InChI

InChI=1S/C19H13ClFN3S/c20-16-5-3-6-17(21)15(16)11-24-10-13(8-12(9-22)19(23)25)14-4-1-2-7-18(14)24/h1-8,10H,11H2,(H2,23,25)