(3S)-5-(4-ethylphenyl)-2-methylsulfonyl-3-thiophen-2-yl-1,3-dihydropyrazole

Systemtic Name: (3S)-5-(4-ethylphenyl)-2-methylsulfonyl-3-thiophen-2-yl-1,3-dihydropyrazole Openeye Name: (3S)-5-(4-ethylphenyl)-2-methylsulfonyl-3-(2-thienyl)-1,3-dihydropyrazole CAS Name: (3S)-5-(4-ethylphenyl)-2-methylsulfonyl-3-thiophen-2-yl-1,3-dihydropyrazole IUPAC Name: (3S)-5-(4-ethylphenyl)-2-methylsulfonyl-3-thiophen-2-yl-1,3-dihydropyrazole Traditional Name: (5S)-3-(4-ethylphenyl)-1-mesyl-5-(2-thienyl)-3-pyrazoline Formula: C16H18N2O2S2 MolecularWeight: 334.45632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(N(N2)S(=O)(=O)C)C3=CC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C[C@H](N(N2)S(=O)(=O)C)C3=CC=CS3

InChI

InChI=1S/C16H18N2O2S2/c1-3-12-6-8-13(9-7-12)14-11-15(16-5-4-10-21-16)18(17-14)22(2,19)20/h4-11,15,17H,3H2,1-2H3/t15-/m0/s1