4-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenyl]-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenyl]-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenyl]-3,5-dimethyl-isoxazole CAS Name: 4-[4-(4-tert-butylcyclohexyl)-3-(4-butyl-1-piperazinyl)phenyl]-3,5-dimethylisoxazole IUPAC Name: 4-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazino)phenyl]-3,5-dimethyl-isoxazole Formula: C29H45N3O MolecularWeight: 451.6871

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=CC(=C2)C3=C(ON=C3C)C)C4CCC(CC4)C(C)(C)C

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=CC(=C2)C3=C(ON=C3C)C)C4CCC(CC4)C(C)(C)C

InChI

InChI=1S/C29H45N3O/c1-7-8-15-31-16-18-32(19-17-31)27-20-24(28-21(2)30-33-22(28)3)11-14-26(27)23-9-12-25(13-10-23)29(4,5)6/h11,14,20,23,25H,7-10,12-13,15-19H2,1-6H3