5-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-methyl-pyrazolo[1,5-a]quinazoline-3-carbaldehyde

Systemtic Name: 5-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-methyl-pyrazolo[1,5-a]quinazoline-3-carbaldehyde Openeye Name: 5-(3-amino-4-oxo-quinazolin-2-yl)sulfanyl-2-methyl-pyrazolo[1,5-a]quinazoline-3-carbaldehyde CAS Name: 5-[(3-amino-4-oxo-2-quinazolinyl)thio]-2-methyl-3-pyrazolo[1,5-a]quinazolinecarboxaldehyde IUPAC Name: 5-(3-amino-4-oxoquinazolin-2-yl)sulfanyl-2-methylpyrazolo[1,5-a]quinazoline-3-carbaldehyde Traditional Name: 5-[(3-amino-4-keto-quinazolin-2-yl)thio]-2-methyl-pyrazolo[1,5-a]quinazoline-3-carbaldehyde Formula: C20H14N6O2S MolecularWeight: 402.42916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C3=CC=CC=C3C(=NC2=C1C=O)SC4=NC5=CC=CC=C5C(=O)N4N

Isomeric SMILES

CC1=NN2C3=CC=CC=C3C(=NC2=C1C=O)SC4=NC5=CC=CC=C5C(=O)N4N

InChI

InChI=1S/C20H14N6O2S/c1-11-14(10-27)17-23-18(13-7-3-5-9-16(13)26(17)24-11)29-20-22-15-8-4-2-6-12(15)19(28)25(20)21/h2-10H,21H2,1H3