4-bromanyl-N-[(Z)-[4-(4-ethoxyphenyl)-5-methyl-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]benzamide bromide

Systemtic Name: 4-bromanyl-N-[(Z)-[4-(4-ethoxyphenyl)-5-methyl-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]benzamide bromide Openeye Name: N-[(Z)-[3-allyl-4-(4-ethoxyphenyl)-5-methyl-thiazol-2-ylidene]amino]-4-bromo-benzamide bromide CAS Name: 4-bromo-N-[(Z)-[4-(4-ethoxyphenyl)-5-methyl-3-prop-2-enyl-2-thiazolylidene]amino]benzamide bromide IUPAC Name: 4-bromo-N-[(Z)-[4-(4-ethoxyphenyl)-5-methyl-3-prop-2-enyl-1,3-thiazol-2-ylidene]amino]benzamide bromide Traditional Name: N-[(Z)-(3-allyl-5-methyl-4-p-phenetyl-4-thiazolin-2-ylidene)amino]-4-bromo-benzamide bromide Formula: C22H22Br2N3O2S- MolecularWeight: 552.30198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(S/C(=N\NC(=O)C3=CC=C(C=C3)Br)/N2CC=C)C.[Br-]

InChI

InChI=1S/C22H22BrN3O2S.BrH/c1-4-14-26-20(16-8-12-19(13-9-16)28-5-2)15(3)29-22(26)25-24-21(27)17-6-10-18(23)11-7-17;/h4,6-13H,1,5,14H2,2-3H3,(H,24,27);1H/p-1/b25-22-;