N-cyclopentyl-N'-[(3,4-dimethoxyphenyl)methyl]-N'-(1,3-thiazol-2-yl)butanediamide

Systemtic Name: N-cyclopentyl-N'-[(3,4-dimethoxyphenyl)methyl]-N'-(1,3-thiazol-2-yl)butanediamide Openeye Name: N-cyclopentyl-N'-[(3,4-dimethoxyphenyl)methyl]-N'-thiazol-2-yl-butanediamide CAS Name: N-cyclopentyl-N'-[(3,4-dimethoxyphenyl)methyl]-N'-(2-thiazolyl)butanediamide IUPAC Name: N-cyclopentyl-N'-[(3,4-dimethoxyphenyl)methyl]-N'-(1,3-thiazol-2-yl)butanediamide Traditional Name: N-cyclopentyl-N'-thiazol-2-yl-N'-veratryl-succinamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(C2=NC=CS2)C(=O)CCC(=O)NC3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(C2=NC=CS2)C(=O)CCC(=O)NC3CCCC3)OC

InChI

InChI=1S/C21H27N3O4S/c1-27-17-8-7-15(13-18(17)28-2)14-24(21-22-11-12-29-21)20(26)10-9-19(25)23-16-5-3-4-6-16/h7-8,11-13,16H,3-6,9-10,14H2,1-2H3,(H,23,25)