[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [2-(3,4-dimethoxyphenyl)-4-thiazolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)C4=NC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)N3CCN(CC3)C4=NC=CC=N4)OC

InChI

InChI=1S/C20H21N5O3S/c1-27-16-5-4-14(12-17(16)28-2)18-23-15(13-29-18)19(26)24-8-10-25(11-9-24)20-21-6-3-7-22-20/h3-7,12-13H,8-11H2,1-2H3