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

Systemtic Name: 2-(naphthalen-1-yloxymethyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Openeye Name: 2-(1-naphthyloxymethyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one CAS Name: 2-(1-naphthalenyloxymethyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one IUPAC Name: 2-(naphthalen-1-yloxymethyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Traditional Name: 2-(1-naphthoxymethyl)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Formula: C20H14N3O2S+ MolecularWeight: 360.40906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCC3=N[N+]4=C(S3)NC5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCC3=N[N+]4=C(S3)NC5=CC=CC=C5C4=O

InChI

InChI=1S/C20H13N3O2S/c24-19-15-9-3-4-10-16(15)21-20-23(19)22-18(26-20)12-25-17-11-5-7-13-6-1-2-8-14(13)17/h1-11H,12H2/p+1