N-(4-aminophenyl)-3-chloranyl-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-aminophenyl)-3-chloranyl-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(4-aminophenyl)-3-chloro-N-[[3-(4-pyridyl)phenyl]methyl]benzothiophene-2-carboxamide CAS Name: N-(4-aminophenyl)-3-chloro-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(4-aminophenyl)-3-chloro-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(4-aminophenyl)-3-chloro-N-[3-(4-pyridyl)benzyl]benzothiophene-2-carboxamide Formula: C27H20ClN3OS MolecularWeight: 469.9852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)N(CC3=CC=CC(=C3)C4=CC=NC=C4)C5=CC=C(C=C5)N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)N(CC3=CC=CC(=C3)C4=CC=NC=C4)C5=CC=C(C=C5)N)Cl

InChI

InChI=1S/C27H20ClN3OS/c28-25-23-6-1-2-7-24(23)33-26(25)27(32)31(22-10-8-21(29)9-11-22)17-18-4-3-5-20(16-18)19-12-14-30-15-13-19/h1-16H,17,29H2