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

Systemtic Name: 2-prop-2-enylsulfanyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Openeye Name: 2-allylsulfanyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one CAS Name: 2-(prop-2-enylthio)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one IUPAC Name: 2-prop-2-enylsulfanyl-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Traditional Name: 2-(allylthio)-10H-[1,3,4]thiadiazolo[2,3-b]quinazolin-4-ium-5-one Formula: C12H10N3OS2+ MolecularWeight: 276.3573

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=N[N+]2=C(S1)NC3=CC=CC=C3C2=O

Isomeric SMILES

C=CCSC1=N[N+]2=C(S1)NC3=CC=CC=C3C2=O

InChI

InChI=1S/C12H9N3OS2/c1-2-7-17-12-14-15-10(16)8-5-3-4-6-9(8)13-11(15)18-12/h2-6H,1,7H2/p+1