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

Systemtic Name: 3-(2-ethylphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(2-ethylphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-(2-ethylphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-(2-ethylphenyl)-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(2-ethylphenyl)-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C2CC(=NN2C(=S)N)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1C2CC(=NN2C(=S)N)C3=CC=CC=C3

InChI

InChI=1S/C18H19N3S/c1-2-13-8-6-7-11-15(13)17-12-16(20-21(17)18(19)22)14-9-4-3-5-10-14/h3-11,17H,2,12H2,1H3,(H2,19,22)