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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)thio]phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)thio]phenyl]-1H-pyrazole-5-carboxamide Formula: C23H16ClN3O3S MolecularWeight: 449.90944

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NNC(=C3)C(=O)NC4=CC=CC=C4SC5=CC=C(C=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NNC(=C3)C(=O)NC4=CC=CC=C4SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H16ClN3O3S/c24-15-6-8-16(9-7-15)31-22-4-2-1-3-17(22)25-23(28)19-12-18(26-27-19)14-5-10-20-21(11-14)30-13-29-20/h1-12H,13H2,(H,25,28)(H,26,27)