4-[[2-[(3,4-dimethoxyphenyl)amino]-1,3-thiazol-4-yl]carbonyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[[2-[(3,4-dimethoxyphenyl)amino]-1,3-thiazol-4-yl]carbonyl]piperazine-1-carbaldehyde Openeye Name: 4-[2-(3,4-dimethoxyanilino)thiazole-4-carbonyl]piperazine-1-carbaldehyde CAS Name: 4-[[2-(3,4-dimethoxyanilino)-4-thiazolyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[2-(3,4-dimethoxyanilino)-1,3-thiazole-4-carbonyl]piperazine-1-carbaldehyde Traditional Name: 4-[2-(3,4-dimethoxyanilino)thiazole-4-carbonyl]piperazine-1-carbaldehyde Formula: C17H20N4O4S MolecularWeight: 376.4301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=CS2)C(=O)N3CCN(CC3)C=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=CS2)C(=O)N3CCN(CC3)C=O)OC

InChI

InChI=1S/C17H20N4O4S/c1-24-14-4-3-12(9-15(14)25-2)18-17-19-13(10-26-17)16(23)21-7-5-20(11-22)6-8-21/h3-4,9-11H,5-8H2,1-2H3,(H,18,19)