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

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-[4-(3,4-dimethylphenyl)-3H-1,3-thiazol-2-ylidene]propanenitrile Openeye Name: 3-(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-[4-(3,4-dimethylphenyl)-3H-thiazol-2-ylidene]propanenitrile CAS Name: 3-(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-2-[4-(3,4-dimethylphenyl)-3H-thiazol-2-ylidene]propanenitrile IUPAC Name: 3-(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-2-[4-(3,4-dimethylphenyl)-3H-1,3-thiazol-2-ylidene]propanenitrile Traditional Name: 3-(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)-2-[4-(3,4-dimethylphenyl)-4-thiazolin-2-ylidene]propionitrile Formula: C21H17BrN2O2S MolecularWeight: 441.34088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=C(C=C3C=C(C(=O)C(=C3)Br)OC)C#N)N2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=C(C=C3C=C(C(=O)C(=C3)Br)OC)C#N)N2)C

InChI

InChI=1S/C21H17BrN2O2S/c1-12-4-5-15(6-13(12)2)18-11-27-21(24-18)16(10-23)7-14-8-17(22)20(25)19(9-14)26-3/h4-9,11,24H,1-3H3