2-(3,4-dimethoxyphenyl)-N-[[1-(dimethylamino)cycloheptyl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[[1-(dimethylamino)cycloheptyl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[[1-(dimethylamino)cycloheptyl]methyl]thiazole-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[[1-(dimethylamino)cycloheptyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[[1-(dimethylamino)cycloheptyl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[[1-(dimethylamino)cycloheptyl]methyl]thiazole-4-carboxamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCCC1)CNC(=O)C2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(C)C1(CCCCCC1)CNC(=O)C2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H31N3O3S/c1-25(2)22(11-7-5-6-8-12-22)15-23-20(26)17-14-29-21(24-17)16-9-10-18(27-3)19(13-16)28-4/h9-10,13-14H,5-8,11-12,15H2,1-4H3,(H,23,26)