N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-nitropyrazol-1-yl)ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-nitropyrazol-1-yl)acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-(3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-nitropyrazol-1-yl)acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-(3-nitropyrazol-1-yl)acetamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CN2C=CC(=N2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CN2C=CC(=N2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN4O3S/c18-12-5-7-13(8-6-12)26-15-4-2-1-3-14(15)19-17(23)11-21-10-9-16(20-21)22(24)25/h1-10H,11H2,(H,19,23)