2-azanyl-9-oxidanylidene-3-(4-oxidanylidene-2-propylsulfanyl-quinazolin-3-yl)-4H-pyrrolo[2,1-b]quinazoline-1-carbonitrile

Systemtic Name: 2-azanyl-9-oxidanylidene-3-(4-oxidanylidene-2-propylsulfanyl-quinazolin-3-yl)-4H-pyrrolo[2,1-b]quinazoline-1-carbonitrile Openeye Name: 2-amino-9-oxo-3-(4-oxo-2-propylsulfanyl-quinazolin-3-yl)-4H-pyrrolo[2,1-b]quinazoline-1-carbonitrile CAS Name: 2-amino-9-oxo-3-[4-oxo-2-(propylthio)-3-quinazolinyl]-4H-pyrrolo[2,1-b]quinazoline-1-carbonitrile IUPAC Name: 2-amino-9-oxo-3-(4-oxo-2-propylsulfanylquinazolin-3-yl)-4H-pyrrolo[2,1-b]quinazoline-1-carbonitrile Traditional Name: 2-amino-9-keto-3-[4-keto-2-(propylthio)quinazolin-3-yl]-4H-pyrrolo[2,1-b]quinazoline-1-carbonitrile Formula: C23H18N6O2S MolecularWeight: 442.49302

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=CC=CC=C2C(=O)N1C3=C4NC5=CC=CC=C5C(=O)N4C(=C3N)C#N

Isomeric SMILES

CCCSC1=NC2=CC=CC=C2C(=O)N1C3=C4NC5=CC=CC=C5C(=O)N4C(=C3N)C#N

InChI

InChI=1S/C23H18N6O2S/c1-2-11-32-23-27-16-10-6-4-8-14(16)22(31)29(23)19-18(25)17(12-24)28-20(19)26-15-9-5-3-7-13(15)21(28)30/h3-10,26H,2,11,25H2,1H3