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

Systemtic Name: [2-(1-ethylindol-2-yl)-1,3-thiazol-4-yl]-(4-pyrimidin-4-ylpiperazin-1-yl)methanone Openeye Name: [2-(1-ethylindol-2-yl)thiazol-4-yl]-(4-pyrimidin-4-ylpiperazin-1-yl)methanone CAS Name: [2-(1-ethyl-2-indolyl)-4-thiazolyl]-[4-(4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [2-(1-ethylindol-2-yl)-1,3-thiazol-4-yl]-(4-pyrimidin-4-ylpiperazin-1-yl)methanone Traditional Name: [2-(1-ethylindol-2-yl)thiazol-4-yl]-[4-(4-pyrimidyl)piperazino]methanone Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C=C1C3=NC(=CS3)C(=O)N4CCN(CC4)C5=NC=NC=C5

Isomeric SMILES

CCN1C2=CC=CC=C2C=C1C3=NC(=CS3)C(=O)N4CCN(CC4)C5=NC=NC=C5

InChI

InChI=1S/C22H22N6OS/c1-2-28-18-6-4-3-5-16(18)13-19(28)21-25-17(14-30-21)22(29)27-11-9-26(10-12-27)20-7-8-23-15-24-20/h3-8,13-15H,2,9-12H2,1H3