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

Systemtic Name: (3R)-3-(furan-2-yl)-5-(4-methoxyphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: (3R)-3-(2-furyl)-5-(4-methoxyphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: (3R)-3-(2-furanyl)-5-(4-methoxyphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: (3R)-3-(furan-2-yl)-5-(4-methoxyphenyl)-N-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: (5R)-5-(2-furyl)-3-(4-methoxyphenyl)-N-phenyl-2-pyrazoline-1-carbothioamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CO3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN([C@H](C2)C3=CC=CO3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2S/c1-25-17-11-9-15(10-12-17)18-14-19(20-8-5-13-26-20)24(23-18)21(27)22-16-6-3-2-4-7-16/h2-13,19H,14H2,1H3,(H,22,27)/t19-/m1/s1