(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-[[(4-chlorophenyl)thio]methyl]-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-[(4-chlorophenyl)sulfanylmethyl]-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-[[(4-chlorophenyl)thio]methyl]-2-phenyl-4-piperonylidene-2-pyrazolin-3-one Formula: C24H17ClN2O3S MolecularWeight: 448.92138

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=NN(C3=O)C4=CC=CC=C4)CSC5=CC=C(C=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)CSC5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H17ClN2O3S/c25-17-7-9-19(10-8-17)31-14-21-20(12-16-6-11-22-23(13-16)30-15-29-22)24(28)27(26-21)18-4-2-1-3-5-18/h1-13H,14-15H2/b20-12-