2-(6-azanyl-4-phenylazanyl-1H-1,3,5-triazin-2-ylidene)-3-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)propanenitrile

Systemtic Name: 2-(6-azanyl-4-phenylazanyl-1H-1,3,5-triazin-2-ylidene)-3-(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)propanenitrile Openeye Name: 2-(6-amino-4-anilino-1H-1,3,5-triazin-2-ylidene)-3-(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)propanenitrile CAS Name: 2-(6-amino-4-anilino-1H-1,3,5-triazin-2-ylidene)-3-(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)propanenitrile IUPAC Name: 2-(6-amino-4-anilino-1H-1,3,5-triazin-2-ylidene)-3-(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile Traditional Name: 2-(6-amino-4-anilino-1H-s-triazin-2-ylidene)-3-(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)propionitrile Formula: C19H15BrN6O2 MolecularWeight: 439.2654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC(=NC(=N2)NC3=CC=CC=C3)N)C#N)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=C2NC(=NC(=N2)NC3=CC=CC=C3)N)C#N)C=C(C1=O)Br

InChI

InChI=1S/C19H15BrN6O2/c1-28-15-9-11(8-14(20)16(15)27)7-12(10-21)17-24-18(22)26-19(25-17)23-13-5-3-2-4-6-13/h2-9H,1H3,(H4,22,23,24,25,26)