2-[(E)-2-(5-bromanylthiophen-2-yl)ethenyl]-3-(3,4-dimethylphenyl)quinazolin-4-one

Systemtic Name: 2-[(E)-2-(5-bromanylthiophen-2-yl)ethenyl]-3-(3,4-dimethylphenyl)quinazolin-4-one Openeye Name: 2-[(E)-2-(5-bromo-2-thienyl)vinyl]-3-(3,4-dimethylphenyl)quinazolin-4-one CAS Name: 2-[(E)-2-(5-bromo-2-thiophenyl)ethenyl]-3-(3,4-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-[(E)-2-(5-bromothiophen-2-yl)ethenyl]-3-(3,4-dimethylphenyl)quinazolin-4-one Traditional Name: 2-[(E)-2-(5-bromo-2-thienyl)vinyl]-3-(3,4-dimethylphenyl)quinazolin-4-one Formula: C22H17BrN2OS MolecularWeight: 437.35218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C=CC4=CC=C(S4)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CC=C(S4)Br)C

InChI

InChI=1S/C22H17BrN2OS/c1-14-7-8-16(13-15(14)2)25-21(12-10-17-9-11-20(23)27-17)24-19-6-4-3-5-18(19)22(25)26/h3-13H,1-2H3/b12-10+