5-[(4-tert-butylphenyl)methylidene]-2-[4-(phenylmethyl)piperazin-1-yl]-1,3-thiazol-4-one

Systemtic Name: 5-[(4-tert-butylphenyl)methylidene]-2-[4-(phenylmethyl)piperazin-1-yl]-1,3-thiazol-4-one Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-[(4-tert-butylphenyl)methylene]thiazol-4-one CAS Name: 5-[(4-tert-butylphenyl)methylidene]-2-[4-(phenylmethyl)-1-piperazinyl]-4-thiazolone IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-[(4-tert-butylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(4-benzylpiperazino)-5-(4-tert-butylbenzylidene)-2-thiazolin-4-one Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3OS/c1-25(2,3)21-11-9-19(10-12-21)17-22-23(29)26-24(30-22)28-15-13-27(14-16-28)18-20-7-5-4-6-8-20/h4-12,17H,13-16,18H2,1-3H3