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

Systemtic Name: 2-phenethyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Openeye Name: 2-phenethyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one CAS Name: 2-phenethyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one IUPAC Name: 2-phenethyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Traditional Name: 2-phenethyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Formula: C17H14N3OS+ MolecularWeight: 308.37756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=N[N+]3=C(S2)NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=N[N+]3=C(S2)NC4=CC=CC=C4C3=O

InChI

InChI=1S/C17H13N3OS/c21-16-13-8-4-5-9-14(13)18-17-20(16)19-15(22-17)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2/p+1