3-(4-bromanyl-3-methyl-phenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one

Systemtic Name: 3-(4-bromanyl-3-methyl-phenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one Openeye Name: 3-(4-bromo-3-methyl-phenyl)-2-[(E)-2-(2-thienyl)vinyl]quinazolin-4-one CAS Name: 3-(4-bromo-3-methylphenyl)-2-[(E)-2-thiophen-2-ylethenyl]-4-quinazolinone IUPAC Name: 3-(4-bromo-3-methylphenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one Traditional Name: 3-(4-bromo-3-methyl-phenyl)-2-[(E)-2-(2-thienyl)vinyl]quinazolin-4-one Formula: C21H15BrN2OS MolecularWeight: 423.3256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=NC3=CC=CC=C3C2=O)C=CC4=CC=CS4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CC=CS4)Br

InChI

InChI=1S/C21H15BrN2OS/c1-14-13-15(8-10-18(14)22)24-20(11-9-16-5-4-12-26-16)23-19-7-3-2-6-17(19)21(24)25/h2-13H,1H3/b11-9+