N-(4-benzamido-2,5-diethoxy-phenyl)-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-benzamido-2,5-diethoxy-phenyl)-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-(4-benzamido-2,5-diethoxy-phenyl)-4-fluoro-3-methyl-benzothiophene-2-carboxamide CAS Name: N-(4-benzamido-2,5-diethoxyphenyl)-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-(4-benzamido-2,5-diethoxyphenyl)-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-(4-benzamido-2,5-diethoxy-phenyl)-4-fluoro-3-methyl-benzothiophene-2-carboxamide Formula: C27H25FN2O4S MolecularWeight: 492.561803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)C3=C(C4=C(C=CC=C4S3)F)C

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)C3=C(C4=C(C=CC=C4S3)F)C

InChI

InChI=1S/C27H25FN2O4S/c1-4-33-21-15-20(30-27(32)25-16(3)24-18(28)12-9-13-23(24)35-25)22(34-5-2)14-19(21)29-26(31)17-10-7-6-8-11-17/h6-15H,4-5H2,1-3H3,(H,29,31)(H,30,32)