2-(3H-1,3-benzothiazol-2-ylidene)-3-[2,3-bis(bromanyl)-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]propanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-[2,3-bis(bromanyl)-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]propanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(2,3-dibromo-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)propanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(2,3-dibromo-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)propanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(2,3-dibromo-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(2,3-dibromo-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)propionitrile Formula: C18H12Br2N2O2S MolecularWeight: 480.17308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C2NC3=CC=CC=C3S2)C#N)C(=C(C1=O)Br)Br

Isomeric SMILES

CCOC1=CC(=CC(=C2NC3=CC=CC=C3S2)C#N)C(=C(C1=O)Br)Br

InChI

InChI=1S/C18H12Br2N2O2S/c1-2-24-13-8-10(15(19)16(20)17(13)23)7-11(9-21)18-22-12-5-3-4-6-14(12)25-18/h3-8,22H,2H2,1H3