3-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-[4-(4-ethoxyphenyl)-3H-1,3-thiazol-2-ylidene]propanenitrile

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-[4-(4-ethoxyphenyl)-3H-1,3-thiazol-2-ylidene]propanenitrile Openeye Name: 3-(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-[4-(4-ethoxyphenyl)-3H-thiazol-2-ylidene]propanenitrile CAS Name: 3-(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-2-[4-(4-ethoxyphenyl)-3H-thiazol-2-ylidene]propanenitrile IUPAC Name: 3-(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-2-[4-(4-ethoxyphenyl)-3H-1,3-thiazol-2-ylidene]propanenitrile Traditional Name: 3-(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)-2-(4-p-phenetyl-4-thiazolin-2-ylidene)propionitrile Formula: C21H17BrN2O3S MolecularWeight: 457.34028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C(C=C3C=C(C(=O)C(=C3)Br)OC)C#N)N2

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C(C=C3C=C(C(=O)C(=C3)Br)OC)C#N)N2

InChI

InChI=1S/C21H17BrN2O3S/c1-3-27-16-6-4-14(5-7-16)18-12-28-21(24-18)15(11-23)8-13-9-17(22)20(25)19(10-13)26-2/h4-10,12,24H,3H2,1-2H3