[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-(5-pyridin-3-yl-1,2-oxazol-3-yl)methanone

Systemtic Name: [4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-(5-pyridin-3-yl-1,2-oxazol-3-yl)methanone Openeye Name: [4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-[5-(3-pyridyl)isoxazol-3-yl]methanone CAS Name: [4-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-1-piperazinyl]-[5-(3-pyridinyl)-3-isoxazolyl]methanone IUPAC Name: [4-(4-tert-butyl-2,6-dimethylphenyl)sulfonylpiperazin-1-yl]-(5-pyridin-3-yl-1,2-oxazol-3-yl)methanone Traditional Name: [4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazino]-[5-(3-pyridyl)isoxazol-3-yl]methanone Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)C3=NOC(=C3)C4=CN=CC=C4)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)C3=NOC(=C3)C4=CN=CC=C4)C)C(C)(C)C

InChI

InChI=1S/C25H30N4O4S/c1-17-13-20(25(3,4)5)14-18(2)23(17)34(31,32)29-11-9-28(10-12-29)24(30)21-15-22(33-27-21)19-7-6-8-26-16-19/h6-8,13-16H,9-12H2,1-5H3