1-[(3S)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[(3S)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[(3S)-3-(2,3-dimethoxyphenyl)-5-(2-thienyl)-1,3-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[(3S)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[(3S)-3-(2,3-dimethoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[(5S)-5-(2,3-dimethoxyphenyl)-3-(2-thienyl)-3-pyrazolin-1-yl]propan-1-one Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C=C(N1)C2=CC=CS2)C3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCC(=O)N1[C@@H](C=C(N1)C2=CC=CS2)C3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C18H20N2O3S/c1-4-17(21)20-14(11-13(19-20)16-9-6-10-24-16)12-7-5-8-15(22-2)18(12)23-3/h5-11,14,19H,4H2,1-3H3/t14-/m0/s1