2-(3,4-dimethoxyphenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thiazole-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-4-thiazolecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]thiazole-4-carboxamide Formula: C23H28N6O3S MolecularWeight: 468.57182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)OC

InChI

InChI=1S/C23H28N6O3S/c1-31-19-6-5-17(15-20(19)32-2)22-27-18(16-33-22)21(30)24-9-4-10-28-11-13-29(14-12-28)23-25-7-3-8-26-23/h3,5-8,15-16H,4,9-14H2,1-2H3,(H,24,30)