4-[4-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[4-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[4-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-3,5-dimethyl-isoxazole CAS Name: 4-[[4-[6-(1-imidazolyl)-4-pyrimidinyl]-1-piperazinyl]sulfonyl]-3,5-dimethylisoxazole IUPAC Name: 4-[4-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[4-(6-imidazol-1-ylpyrimidin-4-yl)piperazino]sulfonyl-3,5-dimethyl-isoxazole Formula: C16H19N7O3S MolecularWeight: 389.43216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4C=CN=C4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4C=CN=C4

InChI

InChI=1S/C16H19N7O3S/c1-12-16(13(2)26-20-12)27(24,25)23-7-5-21(6-8-23)14-9-15(19-10-18-14)22-4-3-17-11-22/h3-4,9-11H,5-8H2,1-2H3