[(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-yl-methanone

Systemtic Name: [(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-yl-methanone Openeye Name: [(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-(2-thienyl)methanone CAS Name: [(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-ylmethanone IUPAC Name: [(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-ylmethanone Traditional Name: [(5R)-3-(4-bromophenyl)-5-(4-methoxyphenyl)-3-pyrazolin-1-yl]-(2-thienyl)methanone Formula: C21H17BrN2O2S MolecularWeight: 441.34088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C=C(NN2C(=O)C3=CC=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2C=C(NN2C(=O)C3=CC=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN2O2S/c1-26-17-10-6-15(7-11-17)19-13-18(14-4-8-16(22)9-5-14)23-24(19)21(25)20-3-2-12-27-20/h2-13,19,23H,1H3/t19-/m1/s1