6-bromanyl-2-(phenylmethylsulfanyl)-3-propyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-(phenylmethylsulfanyl)-3-propyl-quinazolin-4-one Openeye Name: 2-benzylsulfanyl-6-bromo-3-propyl-quinazolin-4-one CAS Name: 6-bromo-2-(phenylmethylthio)-3-propyl-4-quinazolinone IUPAC Name: 2-benzylsulfanyl-6-bromo-3-propylquinazolin-4-one Traditional Name: 2-(benzylthio)-6-bromo-3-propyl-quinazolin-4-one Formula: C18H17BrN2OS MolecularWeight: 389.30938

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3=CC=CC=C3

InChI

InChI=1S/C18H17BrN2OS/c1-2-10-21-17(22)15-11-14(19)8-9-16(15)20-18(21)23-12-13-6-4-3-5-7-13/h3-9,11H,2,10,12H2,1H3