(3S)-3-(4-methoxyphenyl)-N-phenyl-5-thiophen-2-yl-1,3-dihydropyrazole-2-carbothioamide

Systemtic Name: (3S)-3-(4-methoxyphenyl)-N-phenyl-5-thiophen-2-yl-1,3-dihydropyrazole-2-carbothioamide Openeye Name: (3S)-3-(4-methoxyphenyl)-N-phenyl-5-(2-thienyl)-1,3-dihydropyrazole-2-carbothioamide CAS Name: (3S)-3-(4-methoxyphenyl)-N-phenyl-5-thiophen-2-yl-1,3-dihydropyrazole-2-carbothioamide IUPAC Name: (3S)-3-(4-methoxyphenyl)-N-phenyl-5-thiophen-2-yl-1,3-dihydropyrazole-2-carbothioamide Traditional Name: (5S)-5-(4-methoxyphenyl)-N-phenyl-3-(2-thienyl)-3-pyrazoline-1-carbothioamide Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C=C(NN2C(=S)NC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2C=C(NN2C(=S)NC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C21H19N3OS2/c1-25-17-11-9-15(10-12-17)19-14-18(20-8-5-13-27-20)23-24(19)21(26)22-16-6-3-2-4-7-16/h2-14,19,23H,1H3,(H,22,26)/t19-/m0/s1