2-tert-butyl-5-[[4-(1H-indol-4-yl)piperazin-1-yl]methyl]-4-(phenylmethyl)-1,3-oxazole

Systemtic Name: 2-tert-butyl-5-[[4-(1H-indol-4-yl)piperazin-1-yl]methyl]-4-(phenylmethyl)-1,3-oxazole Openeye Name: 4-benzyl-2-tert-butyl-5-[[4-(1H-indol-4-yl)piperazin-1-yl]methyl]oxazole CAS Name: 2-tert-butyl-5-[[4-(1H-indol-4-yl)-1-piperazinyl]methyl]-4-(phenylmethyl)oxazole IUPAC Name: 4-benzyl-2-tert-butyl-5-[[4-(1H-indol-4-yl)piperazin-1-yl]methyl]-1,3-oxazole Traditional Name: 4-benzyl-2-tert-butyl-5-[[4-(1H-indol-4-yl)piperazino]methyl]oxazole Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(O1)CN2CCN(CC2)C3=CC=CC4=C3C=CN4)CC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=NC(=C(O1)CN2CCN(CC2)C3=CC=CC4=C3C=CN4)CC5=CC=CC=C5

InChI

InChI=1S/C27H32N4O/c1-27(2,3)26-29-23(18-20-8-5-4-6-9-20)25(32-26)19-30-14-16-31(17-15-30)24-11-7-10-22-21(24)12-13-28-22/h4-13,28H,14-19H2,1-3H3