3-phenyl-2-phenylsulfanyl-4aH-quinazolin-3-ium-4-one

Systemtic Name: 3-phenyl-2-phenylsulfanyl-4aH-quinazolin-3-ium-4-one Openeye Name: 3-phenyl-2-phenylsulfanyl-4aH-quinazolin-3-ium-4-one CAS Name: 3-phenyl-2-(phenylthio)-4aH-quinazolin-3-ium-4-one IUPAC Name: 3-phenyl-2-phenylsulfanyl-4aH-quinazolin-3-ium-4-one Traditional Name: 3-phenyl-2-(phenylthio)-4aH-quinazolin-3-ium-4-one Formula: C20H15N2OS+ MolecularWeight: 331.4109

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(N=C3C=CC=CC3C2=O)SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(N=C3C=CC=CC3C2=O)SC4=CC=CC=C4

InChI

InChI=1S/C20H15N2OS/c23-19-17-13-7-8-14-18(17)21-20(24-16-11-5-2-6-12-16)22(19)15-9-3-1-4-10-15/h1-14,17H/q+1