2,6-bis(azanyl)-8-[(3-bromophenyl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2,6-bis(azanyl)-8-[(3-bromophenyl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2,6-diamino-8-[(3-bromophenyl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2,6-diamino-8-[[(3-bromophenyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2,6-diamino-8-[(3-bromophenyl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2,6-diamino-8-[[(3-bromophenyl)thio]methyl]-1H-quinazolin-4-one Formula: C15H13BrN4OS MolecularWeight: 377.25892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)SCC2=C3C(=CC(=C2)N)C(=O)N=C(N3)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)SCC2=C3C(=CC(=C2)N)C(=O)N=C(N3)N

InChI

InChI=1S/C15H13BrN4OS/c16-9-2-1-3-11(5-9)22-7-8-4-10(17)6-12-13(8)19-15(18)20-14(12)21/h1-6H,7,17H2,(H3,18,19,20,21)