3-morpholin-4-ylcarbonyl-N-propan-2-yl-4-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carbothioamide

Systemtic Name: 3-morpholin-4-ylcarbonyl-N-propan-2-yl-4-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carbothioamide Openeye Name: N-isopropyl-3-(morpholine-4-carbonyl)-4-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carbothioamide CAS Name: 3-[4-morpholinyl(oxo)methyl]-N-propan-2-yl-4-(3,4,5-trimethoxyphenyl)-1-pyrrolidinecarbothioamide IUPAC Name: 3-(morpholine-4-carbonyl)-N-propan-2-yl-4-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carbothioamide Traditional Name: N-isopropyl-3-(morpholine-4-carbonyl)-4-(3,4,5-trimethoxyphenyl)pyrrolidine-1-carbothioamide Formula: C22H33N3O5S MolecularWeight: 451.57952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)N1CC(C(C1)C(=O)N2CCOCC2)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(C)NC(=S)N1CC(C(C1)C(=O)N2CCOCC2)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H33N3O5S/c1-14(2)23-22(31)25-12-16(17(13-25)21(26)24-6-8-30-9-7-24)15-10-18(27-3)20(29-5)19(11-15)28-4/h10-11,14,16-17H,6-9,12-13H2,1-5H3,(H,23,31)