methyl 4-[(3R)-5-(2,5-dimethylthiophen-3-yl)-2-phenyl-3,4-dihydropyrazol-3-yl]benzoate

Systemtic Name: methyl 4-[(3R)-5-(2,5-dimethylthiophen-3-yl)-2-phenyl-3,4-dihydropyrazol-3-yl]benzoate Openeye Name: methyl 4-[(3R)-5-(2,5-dimethyl-3-thienyl)-2-phenyl-3,4-dihydropyrazol-3-yl]benzoate CAS Name: 4-[(3R)-5-(2,5-dimethyl-3-thiophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3R)-5-(2,5-dimethylthiophen-3-yl)-2-phenyl-3,4-dihydropyrazol-3-yl]benzoate Traditional Name: 4-[(3R)-5-(2,5-dimethyl-3-thienyl)-2-phenyl-2-pyrazolin-3-yl]benzoic acid methyl ester Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NN(C(C2)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NN([C@H](C2)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O2S/c1-15-13-20(16(2)28-15)21-14-22(25(24-21)19-7-5-4-6-8-19)17-9-11-18(12-10-17)23(26)27-3/h4-13,22H,14H2,1-3H3/t22-/m1/s1