2-(3H-1,3-benzothiazol-2-ylidene)-3-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)propanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)propanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)propanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)propanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)propionitrile Formula: C17H11BrN2O2S MolecularWeight: 387.25044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC3=CC=CC=C3S2)C#N)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=C2NC3=CC=CC=C3S2)C#N)C=C(C1=O)Br

InChI

InChI=1S/C17H11BrN2O2S/c1-22-14-8-10(7-12(18)16(14)21)6-11(9-19)17-20-13-4-2-3-5-15(13)23-17/h2-8,20H,1H3