4-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]quinazoline

Systemtic Name: 4-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]quinazoline Openeye Name: 4-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]quinazoline CAS Name: 4-[(2-bromo-4,5-dimethoxyphenyl)methylthio]quinazoline IUPAC Name: 4-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]quinazoline Traditional Name: 4-[(2-bromo-4,5-dimethoxy-benzyl)thio]quinazoline Formula: C17H15BrN2O2S MolecularWeight: 391.2822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CSC2=NC=NC3=CC=CC=C32)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CSC2=NC=NC3=CC=CC=C32)Br)OC

InChI

InChI=1S/C17H15BrN2O2S/c1-21-15-7-11(13(18)8-16(15)22-2)9-23-17-12-5-3-4-6-14(12)19-10-20-17/h3-8,10H,9H2,1-2H3