(4-methyl-2-pyrrol-1-yl-1,3-thiazol-5-yl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (4-methyl-2-pyrrol-1-yl-1,3-thiazol-5-yl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (4-methyl-2-pyrrol-1-yl-thiazol-5-yl)-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: [4-methyl-2-(1-pyrrolyl)-5-thiazolyl]-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4-methyl-2-pyrrol-1-yl-1,3-thiazol-5-yl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (4-methyl-2-pyrrol-1-yl-thiazol-5-yl)-[4-(6-piperidinopyrimidin-4-yl)piperazino]methanone Formula: C22H27N7OS MolecularWeight: 437.56108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C=CC=C2)C(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCCC5

Isomeric SMILES

CC1=C(SC(=N1)N2C=CC=C2)C(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCCC5

InChI

InChI=1S/C22H27N7OS/c1-17-20(31-22(25-17)29-9-5-6-10-29)21(30)28-13-11-27(12-14-28)19-15-18(23-16-24-19)26-7-3-2-4-8-26/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3