N-[2-(4-chlorophenyl)sulfanylphenyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-5-(1-pyrazolylmethyl)-2-furancarboxamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-5-(pyrazol-1-ylmethyl)-2-furamide Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC=C(O2)CN3C=CC=N3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC=C(O2)CN3C=CC=N3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClN3O2S/c22-15-6-9-17(10-7-15)28-20-5-2-1-4-18(20)24-21(26)19-11-8-16(27-19)14-25-13-3-12-23-25/h1-13H,14H2,(H,24,26)