5-(4-methoxyphenyl)-N-methyl-3-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-(4-methoxyphenyl)-N-methyl-3-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-(4-methoxyphenyl)-N-methyl-3-(2-thienyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-(4-methoxyphenyl)-N-methyl-3-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-(4-methoxyphenyl)-N-methyl-3-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-(4-methoxyphenyl)-N-methyl-5-(2-thienyl)-2-pyrazoline-1-carbothioamide Formula: C16H17N3OS2 MolecularWeight: 331.45568

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CS3

Isomeric SMILES

CNC(=S)N1C(CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CS3

InChI

InChI=1S/C16H17N3OS2/c1-17-16(21)19-14(15-4-3-9-22-15)10-13(18-19)11-5-7-12(20-2)8-6-11/h3-9,14H,10H2,1-2H3,(H,17,21)