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

Systemtic Name: [2-(1-methylindol-2-yl)-1,3-thiazol-4-yl]-(4-pyrimidin-4-ylpiperazin-1-yl)methanone Openeye Name: [2-(1-methylindol-2-yl)thiazol-4-yl]-(4-pyrimidin-4-ylpiperazin-1-yl)methanone CAS Name: [2-(1-methyl-2-indolyl)-4-thiazolyl]-[4-(4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [2-(1-methylindol-2-yl)-1,3-thiazol-4-yl]-(4-pyrimidin-4-ylpiperazin-1-yl)methanone Traditional Name: [2-(1-methylindol-2-yl)thiazol-4-yl]-[4-(4-pyrimidyl)piperazino]methanone Formula: C21H20N6OS MolecularWeight: 404.4881

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C3=NC(=CS3)C(=O)N4CCN(CC4)C5=NC=NC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C3=NC(=CS3)C(=O)N4CCN(CC4)C5=NC=NC=C5

InChI

InChI=1S/C21H20N6OS/c1-25-17-5-3-2-4-15(17)12-18(25)20-24-16(13-29-20)21(28)27-10-8-26(9-11-27)19-6-7-22-14-23-19/h2-7,12-14H,8-11H2,1H3