3-(5-bromanyl-1H-indol-3-yl)-2-(6-methoxy-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: 3-(5-bromanyl-1H-indol-3-yl)-2-(6-methoxy-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: 3-(5-bromo-1H-indol-3-yl)-2-(6-methoxy-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: 3-(5-bromo-1H-indol-3-yl)-2-(6-methoxy-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: 3-(5-bromo-1H-indol-3-yl)-2-(6-methoxy-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: 3-(5-bromo-1H-indol-3-yl)-2-(4-keto-6-methoxy-1H-quinazolin-2-yl)acrylonitrile Formula: C20H13BrN4O2 MolecularWeight: 421.24682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=NC2=O)C(=CC3=CNC4=C3C=C(C=C4)Br)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=NC2=O)C(=CC3=CNC4=C3C=C(C=C4)Br)C#N

InChI

InChI=1S/C20H13BrN4O2/c1-27-14-3-5-18-16(8-14)20(26)25-19(24-18)11(9-22)6-12-10-23-17-4-2-13(21)7-15(12)17/h2-8,10,23H,1H3,(H,24,25,26)