3-(4-bromanyl-2-chloranyl-phenyl)-6-methyl-2-prop-2-ynylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-bromanyl-2-chloranyl-phenyl)-6-methyl-2-prop-2-ynylsulfanyl-quinazolin-4-one Openeye Name: 3-(4-bromo-2-chloro-phenyl)-6-methyl-2-prop-2-ynylsulfanyl-quinazolin-4-one CAS Name: 3-(4-bromo-2-chlorophenyl)-6-methyl-2-(prop-2-ynylthio)-4-quinazolinone IUPAC Name: 3-(4-bromo-2-chlorophenyl)-6-methyl-2-prop-2-ynylsulfanylquinazolin-4-one Traditional Name: 3-(4-bromo-2-chloro-phenyl)-6-methyl-2-(propargylthio)quinazolin-4-one Formula: C18H12BrClN2OS MolecularWeight: 419.72268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C3=C(C=C(C=C3)Br)Cl)SCC#C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C3=C(C=C(C=C3)Br)Cl)SCC#C

InChI

InChI=1S/C18H12BrClN2OS/c1-3-8-24-18-21-15-6-4-11(2)9-13(15)17(23)22(18)16-7-5-12(19)10-14(16)20/h1,4-7,9-10H,8H2,2H3