[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]-(2-thiophen-2-ylpyrrolidin-1-yl)methanone

Systemtic Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]-(2-thiophen-2-ylpyrrolidin-1-yl)methanone Openeye Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]-[2-(2-thienyl)pyrrolidin-1-yl]methanone CAS Name: [5-(3,4-dimethoxyphenyl)-3-isoxazolyl]-(2-thiophen-2-yl-1-pyrrolidinyl)methanone IUPAC Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]-(2-thiophen-2-ylpyrrolidin-1-yl)methanone Traditional Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]-[2-(2-thienyl)pyrrolidino]methanone Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)N3CCCC3C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)N3CCCC3C4=CC=CS4)OC

InChI

InChI=1S/C20H20N2O4S/c1-24-16-8-7-13(11-18(16)25-2)17-12-14(21-26-17)20(23)22-9-3-5-15(22)19-6-4-10-27-19/h4,6-8,10-12,15H,3,5,9H2,1-2H3