3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-phenyl-5-(2-thienyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-phenyl-3-(2-thienyl)-2-pyrazoline-1-carbothioamide Formula: C30H25N5OS2 MolecularWeight: 535.6824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C3CC(=NN3C(=S)NC4=CC=CC=C4)C5=CC=CS5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C3CC(=NN3C(=S)NC4=CC=CC=C4)C5=CC=CS5)C6=CC=CC=C6

InChI

InChI=1S/C30H25N5OS2/c1-36-24-16-14-21(15-17-24)29-25(20-34(33-29)23-11-6-3-7-12-23)27-19-26(28-13-8-18-38-28)32-35(27)30(37)31-22-9-4-2-5-10-22/h2-18,20,27H,19H2,1H3,(H,31,37)