3-(furan-2-yl)-5-(4-methylphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-(furan-2-yl)-5-(4-methylphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(2-furyl)-N-phenyl-5-(p-tolyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-(2-furanyl)-5-(4-methylphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-(furan-2-yl)-5-(4-methylphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(2-furyl)-N-phenyl-3-(p-tolyl)-2-pyrazoline-1-carbothioamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CO3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CO3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C21H19N3OS/c1-15-9-11-16(12-10-15)18-14-19(20-8-5-13-25-20)24(23-18)21(26)22-17-6-3-2-4-7-17/h2-13,19H,14H2,1H3,(H,22,26)