(E)-3-(4-bromanylthiophen-2-yl)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-bromanylthiophen-2-yl)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-bromo-2-thienyl)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-bromo-2-thiophenyl)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(4-bromothiophen-2-yl)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-bromo-2-thienyl)-2-(7-chloro-4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C15H7BrClN3OS MolecularWeight: 392.65758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=NC2=O)C(=CC3=CC(=CS3)Br)C#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=NC2=O)/C(=C/C3=CC(=CS3)Br)/C#N

InChI

InChI=1S/C15H7BrClN3OS/c16-9-4-11(22-7-9)3-8(6-18)14-19-13-5-10(17)1-2-12(13)15(21)20-14/h1-5,7H,(H,19,20,21)/b8-3+