2-(4-tert-butylphenyl)-5-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(4-tert-butylphenyl)-5-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-tert-butylphenyl)-5-[4-(3-chlorophenyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-(4-tert-butylphenyl)-5-[4-(3-chlorophenyl)-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-(4-tert-butylphenyl)-5-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-tert-butylphenyl)-5-[4-(3-chlorophenyl)piperazino]oxazole-4-carbonitrile Formula: C24H25ClN4O MolecularWeight: 420.9345

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N

InChI

InChI=1S/C24H25ClN4O/c1-24(2,3)18-9-7-17(8-10-18)22-27-21(16-26)23(30-22)29-13-11-28(12-14-29)20-6-4-5-19(25)15-20/h4-10,15H,11-14H2,1-3H3