2-(4-ethoxyphenyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one

Systemtic Name: 2-(4-ethoxyphenyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Openeye Name: 2-(4-ethoxyphenyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one CAS Name: 2-(4-ethoxyphenyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one IUPAC Name: 2-(4-ethoxyphenyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Traditional Name: 2-p-phenetyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Formula: C17H14N3O2S+ MolecularWeight: 324.37696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=N[N+]3=C(S2)NC4=CC=CC=C4C3=O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=N[N+]3=C(S2)NC4=CC=CC=C4C3=O

InChI

InChI=1S/C17H13N3O2S/c1-2-22-12-9-7-11(8-10-12)15-19-20-16(21)13-5-3-4-6-14(13)18-17(20)23-15/h3-10H,2H2,1H3/p+1