N-[2-(4-chlorophenyl)sulfanylphenyl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-5-[(4-nitro-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-5-[(4-nitropyrazol-1-yl)methyl]-2-furamide Formula: C21H15ClN4O4S MolecularWeight: 454.8862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O4S/c22-14-5-8-17(9-6-14)31-20-4-2-1-3-18(20)24-21(27)19-10-7-16(30-19)13-25-12-15(11-23-25)26(28)29/h1-12H,13H2,(H,24,27)