6,8-bis(bromanyl)-3-(4-methoxyphenyl)-2-sulfanylidene-4aH-quinazolin-1-ium-4-one

Systemtic Name: 6,8-bis(bromanyl)-3-(4-methoxyphenyl)-2-sulfanylidene-4aH-quinazolin-1-ium-4-one Openeye Name: 6,8-dibromo-3-(4-methoxyphenyl)-2-thioxo-4aH-quinazolin-1-ium-4-one CAS Name: 6,8-dibromo-3-(4-methoxyphenyl)-2-sulfanylidene-4aH-quinazolin-1-ium-4-one IUPAC Name: 6,8-dibromo-3-(4-methoxyphenyl)-2-sulfanylidene-4aH-quinazolin-1-ium-4-one Traditional Name: 6,8-dibromo-3-(4-methoxyphenyl)-2-thioxo-4aH-quinazolin-1-ium-4-one Formula: C15H11Br2N2O2S+ MolecularWeight: 443.13304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3C=C(C=C(C3=[NH+]C2=S)Br)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3C=C(C=C(C3=[NH+]C2=S)Br)Br

InChI

InChI=1S/C15H10Br2N2O2S/c1-21-10-4-2-9(3-5-10)19-14(20)11-6-8(16)7-12(17)13(11)18-15(19)22/h2-7,11H,1H3/p+1