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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(3,4-dimethoxyphenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(3,4-dimethoxyphenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(3,4-dimethoxyphenyl)-5-phenyl-2-pyrazoline-1-carbothioamide Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O2S/c1-22-16-9-8-13(10-17(16)23-2)14-11-15(21(20-14)18(19)24)12-6-4-3-5-7-12/h3-10,15H,11H2,1-2H3,(H2,19,24)