1-[4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]phenyl]ethanone bromide

Systemtic Name: 1-[4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]phenyl]ethanone bromide Openeye Name: 1-[4-[[3-allyl-4-(4-ethoxyphenyl)thiazol-2-ylidene]amino]phenyl]ethanone bromide CAS Name: 1-[4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-2-thiazolylidene]amino]phenyl]ethanone bromide IUPAC Name: 1-[4-[[4-(4-ethoxyphenyl)-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]phenyl]ethanone bromide Traditional Name: 1-[4-[(3-allyl-4-p-phenetyl-4-thiazolin-2-ylidene)amino]phenyl]ethanone bromide Formula: C22H22BrN2O2S- MolecularWeight: 458.39128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=NC3=CC=C(C=C3)C(=O)C)N2CC=C.[Br-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=NC3=CC=C(C=C3)C(=O)C)N2CC=C.[Br-]

InChI

InChI=1S/C22H22N2O2S.BrH/c1-4-14-24-21(18-8-12-20(13-9-18)26-5-2)15-27-22(24)23-19-10-6-17(7-11-19)16(3)25;/h4,6-13,15H,1,5,14H2,2-3H3;1H/p-1