3-chloranyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzothiophene-2-carboxamide Formula: C20H16ClN3OS MolecularWeight: 381.87854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4)Cl

InChI

InChI=1S/C20H16ClN3OS/c21-18-16-4-1-2-5-17(16)26-19(18)20(25)22-12-10-14-6-8-15(9-7-14)24-13-3-11-23-24/h1-9,11,13H,10,12H2,(H,22,25)