N-[4-[4-azanyl-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]ethanesulfonamide

Systemtic Name: N-[4-[4-azanyl-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]ethanesulfonamide Openeye Name: N-[4-[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]ethanesulfonamide CAS Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-2-quinazolinyl]thio]phenyl]ethanesulfonamide IUPAC Name: N-[4-[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]ethanesulfonamide Traditional Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]thio]phenyl]ethanesulfonamide Formula: C20H20N6O2S2 MolecularWeight: 440.5418

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=C(C=C1)SC2=NC3=CC=CC(=C3C(=N2)N)C4=NNC(=C4)C

Isomeric SMILES

CCS(=O)(=O)NC1=CC=C(C=C1)SC2=NC3=CC=CC(=C3C(=N2)N)C4=NNC(=C4)C

InChI

InChI=1S/C20H20N6O2S2/c1-3-30(27,28)26-13-7-9-14(10-8-13)29-20-22-16-6-4-5-15(18(16)19(21)23-20)17-11-12(2)24-25-17/h4-11,26H,3H2,1-2H3,(H,24,25)(H2,21,22,23)