(6E)-6-[(3-bromanyl-5-methylsulfanyl-phenyl)methylidene]-4-methyl-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one

Systemtic Name: (6E)-6-[(3-bromanyl-5-methylsulfanyl-phenyl)methylidene]-4-methyl-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one Openeye Name: (6E)-6-[(3-bromo-5-methylsulfanyl-phenyl)methylene]-4-methyl-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one CAS Name: (6E)-6-[[3-bromo-5-(methylthio)phenyl]methylidene]-4-methyl-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one IUPAC Name: (6E)-6-[(3-bromo-5-methylsulfanylphenyl)methylidene]-4-methyl-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one Traditional Name: (6E)-6-[3-bromo-5-(methylthio)benzylidene]-4-methyl-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one Formula: C21H19BrN2OS MolecularWeight: 427.35736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C3C(=CC4=CC(=CC(=C4)Br)SC)CCCN3C2=O

Isomeric SMILES

CC1=CC=CC2=C1N=C3/C(=C/C4=CC(=CC(=C4)Br)SC)/CCCN3C2=O

InChI

InChI=1S/C21H19BrN2OS/c1-13-5-3-7-18-19(13)23-20-15(6-4-8-24(20)21(18)25)9-14-10-16(22)12-17(11-14)26-2/h3,5,7,9-12H,4,6,8H2,1-2H3/b15-9+