2-(3,4-dimethoxyphenyl)-N-[(2S)-3-methyl-2-morpholin-4-yl-butyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[(2S)-3-methyl-2-morpholin-4-yl-butyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[(2S)-3-methyl-2-morpholino-butyl]thiazole-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[(2S)-3-methyl-2-(4-morpholinyl)butyl]-4-thiazolecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[(2S)-3-methyl-2-morpholino-butyl]thiazole-4-carboxamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=CSC(=N1)C2=CC(=C(C=C2)OC)OC)N3CCOCC3

Isomeric SMILES

CC(C)[C@@H](CNC(=O)C1=CSC(=N1)C2=CC(=C(C=C2)OC)OC)N3CCOCC3

InChI

InChI=1S/C21H29N3O4S/c1-14(2)17(24-7-9-28-10-8-24)12-22-20(25)16-13-29-21(23-16)15-5-6-18(26-3)19(11-15)27-4/h5-6,11,13-14,17H,7-10,12H2,1-4H3,(H,22,25)/t17-/m1/s1