5-[(4-butoxyphenyl)methylidene]-2-[4-(2-methylphenyl)piperazin-1-yl]-1,3-thiazol-4-one

Systemtic Name: 5-[(4-butoxyphenyl)methylidene]-2-[4-(2-methylphenyl)piperazin-1-yl]-1,3-thiazol-4-one Openeye Name: 5-[(4-butoxyphenyl)methylene]-2-[4-(o-tolyl)piperazin-1-yl]thiazol-4-one CAS Name: 5-[(4-butoxyphenyl)methylidene]-2-[4-(2-methylphenyl)-1-piperazinyl]-4-thiazolone IUPAC Name: 5-[(4-butoxyphenyl)methylidene]-2-[4-(2-methylphenyl)piperazin-1-yl]-1,3-thiazol-4-one Traditional Name: 5-(4-butoxybenzylidene)-2-[4-(o-tolyl)piperazino]-2-thiazolin-4-one Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC=C4C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC=C4C

InChI

InChI=1S/C25H29N3O2S/c1-3-4-17-30-21-11-9-20(10-12-21)18-23-24(29)26-25(31-23)28-15-13-27(14-16-28)22-8-6-5-7-19(22)2/h5-12,18H,3-4,13-17H2,1-2H3