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

Systemtic Name: (E)-3-(5-bromanyl-1H-indol-3-yl)-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(5-bromo-1H-indol-3-yl)-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(5-bromo-1H-indol-3-yl)-2-(4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(5-bromo-1H-indol-3-yl)-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(5-bromo-1H-indol-3-yl)-2-(4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C19H11BrN4O MolecularWeight: 391.22084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=CC3=CNC4=C3C=C(C=C4)Br)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)/C(=C/C3=CNC4=C3C=C(C=C4)Br)/C#N

InChI

InChI=1S/C19H11BrN4O/c20-13-5-6-16-15(8-13)12(10-22-16)7-11(9-21)18-23-17-4-2-1-3-14(17)19(25)24-18/h1-8,10,22H,(H,23,24,25)/b11-7+