5-(4-chlorophenyl)sulfanyl-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one

Systemtic Name: 5-(4-chlorophenyl)sulfanyl-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Openeye Name: 5-(4-chlorophenyl)sulfanyl-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one CAS Name: 5-[(4-chlorophenyl)thio]-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one IUPAC Name: 5-(4-chlorophenyl)sulfanyl-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Traditional Name: 5-[(4-chlorophenyl)thio]-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Formula: C21H13ClN3OS+ MolecularWeight: 390.86542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=[N+](C(=O)C4=CC=CC=C4N3)N=C2SC5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C3=[N+](C(=O)C4=CC=CC=C4N3)N=C2SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C21H12ClN3OS/c22-13-9-11-14(12-10-13)27-20-16-6-2-1-5-15(16)19-23-18-8-4-3-7-17(18)21(26)25(19)24-20/h1-12H/p+1