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

Systemtic Name: (3S)-3-(4-methylphenyl)-N-phenyl-5-thiophen-2-yl-1,3-dihydropyrazole-2-carbothioamide Openeye Name: (3S)-N-phenyl-3-(p-tolyl)-5-(2-thienyl)-1,3-dihydropyrazole-2-carbothioamide CAS Name: (3S)-3-(4-methylphenyl)-N-phenyl-5-thiophen-2-yl-1,3-dihydropyrazole-2-carbothioamide IUPAC Name: (3S)-3-(4-methylphenyl)-N-phenyl-5-thiophen-2-yl-1,3-dihydropyrazole-2-carbothioamide Traditional Name: (5S)-N-phenyl-5-(p-tolyl)-3-(2-thienyl)-3-pyrazoline-1-carbothioamide Formula: C21H19N3S2 MolecularWeight: 377.52566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C=C(NN2C(=S)NC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2C=C(NN2C(=S)NC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C21H19N3S2/c1-15-9-11-16(12-10-15)19-14-18(20-8-5-13-26-20)23-24(19)21(25)22-17-6-3-2-4-7-17/h2-14,19,23H,1H3,(H,22,25)/t19-/m0/s1