2-[(2-methylphenyl)amino]-5-[(4-octoxyphenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-[(2-methylphenyl)amino]-5-[(4-octoxyphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(2-methylanilino)-5-[(4-octoxyphenyl)methylene]thiazol-4-one CAS Name: 2-(2-methylanilino)-5-[(4-octoxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-(2-methylanilino)-5-[(4-octoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 5-(4-octoxybenzylidene)-2-(o-toluidino)-2-thiazolin-4-one Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=CC=C3C

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=CC=C3C

InChI

InChI=1S/C25H30N2O2S/c1-3-4-5-6-7-10-17-29-21-15-13-20(14-16-21)18-23-24(28)27-25(30-23)26-22-12-9-8-11-19(22)2/h8-9,11-16,18H,3-7,10,17H2,1-2H3,(H,26,27,28)