N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C16H11ClN4O3S MolecularWeight: 374.80154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC(=NN2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC(=NN2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H11ClN4O3S/c17-10-5-7-11(8-6-10)25-14-4-2-1-3-12(14)18-16(22)13-9-15(20-19-13)21(23)24/h1-9H,(H,18,22)(H,19,20)