5-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylidene]-2-[(4-methylphenyl)amino]-1,3-thiazol-4-one

Systemtic Name: 5-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylidene]-2-[(4-methylphenyl)amino]-1,3-thiazol-4-one Openeye Name: 5-[(3-bromo-5-methoxy-4-propoxy-phenyl)methylene]-2-(4-methylanilino)thiazol-4-one CAS Name: 5-[(3-bromo-5-methoxy-4-propoxyphenyl)methylidene]-2-(4-methylanilino)-4-thiazolone IUPAC Name: 5-[(3-bromo-5-methoxy-4-propoxyphenyl)methylidene]-2-(4-methylanilino)-1,3-thiazol-4-one Traditional Name: 5-(3-bromo-5-methoxy-4-propoxy-benzylidene)-2-(p-toluidino)-2-thiazolin-4-one Formula: C21H21BrN2O3S MolecularWeight: 461.37204

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C)OC

InChI

InChI=1S/C21H21BrN2O3S/c1-4-9-27-19-16(22)10-14(11-17(19)26-3)12-18-20(25)24-21(28-18)23-15-7-5-13(2)6-8-15/h5-8,10-12H,4,9H2,1-3H3,(H,23,24,25)