5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]quinazolino[2,3-a]phthalazin-8-one

Systemtic Name: 5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]quinazolino[2,3-a]phthalazin-8-one Openeye Name: 5-(1-phenyltetrazol-5-yl)sulfanylquinazolino[2,3-a]phthalazin-8-one CAS Name: 5-[(1-phenyl-5-tetrazolyl)thio]-8-quinazolino[2,3-a]phthalazinone IUPAC Name: 5-(1-phenyltetrazol-5-yl)sulfanylquinazolino[2,3-a]phthalazin-8-one Traditional Name: 5-[(1-phenyltetrazol-5-yl)thio]quinazolino[2,3-a]phthalazin-8-one Formula: C22H13N7OS MolecularWeight: 423.44992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SC3=NN4C(=NC5=CC=CC=C5C4=O)C6=CC=CC=C63

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SC3=NN4C(=NC5=CC=CC=C5C4=O)C6=CC=CC=C63

InChI

InChI=1S/C22H13N7OS/c30-21-17-12-6-7-13-18(17)23-19-15-10-4-5-11-16(15)20(25-29(19)21)31-22-24-26-27-28(22)14-8-2-1-3-9-14/h1-13H