3-(3,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(3,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-(3,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-2-pyrazoline-1-carbothioamide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC(=C(C=C3)OC)OC)C(=S)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC(=C(C=C3)OC)OC)C(=S)N

InChI

InChI=1S/C19H21N3O3S/c1-23-14-7-4-12(5-8-14)15-11-16(22(21-15)19(20)26)13-6-9-17(24-2)18(10-13)25-3/h4-10,16H,11H2,1-3H3,(H2,20,26)