N-[5-[(4-cyanophenyl)methyl]-1,3-thiazol-2-yl]-4-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-[(4-cyanophenyl)methyl]-1,3-thiazol-2-yl]-4-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[5-[(4-cyanophenyl)methyl]thiazol-2-yl]-4-fluoro-benzothiophene-2-carboxamide CAS Name: N-[5-[(4-cyanophenyl)methyl]-2-thiazolyl]-4-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-[(4-cyanophenyl)methyl]-1,3-thiazol-2-yl]-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(4-cyanobenzyl)thiazol-2-yl]-4-fluoro-benzothiophene-2-carboxamide Formula: C20H12FN3OS2 MolecularWeight: 393.457183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)C#N)F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)C#N)F

InChI

InChI=1S/C20H12FN3OS2/c21-16-2-1-3-17-15(16)9-18(27-17)19(25)24-20-23-11-14(26-20)8-12-4-6-13(10-22)7-5-12/h1-7,9,11H,8H2,(H,23,24,25)