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

Systemtic Name: N-[4-[4-azanyl-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]-2-(dimethylamino)ethanamide Openeye Name: N-[4-[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]-2-(dimethylamino)acetamide CAS Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-2-quinazolinyl]thio]phenyl]-2-(dimethylamino)acetamide IUPAC Name: N-[4-[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]-2-(dimethylamino)acetamide Traditional Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]thio]phenyl]-2-(dimethylamino)acetamide Formula: C22H23N7OS MolecularWeight: 433.52932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C2=C3C(=CC=C2)N=C(N=C3N)SC4=CC=C(C=C4)NC(=O)CN(C)C

Isomeric SMILES

CC1=CC(=NN1)C2=C3C(=CC=C2)N=C(N=C3N)SC4=CC=C(C=C4)NC(=O)CN(C)C

InChI

InChI=1S/C22H23N7OS/c1-13-11-18(28-27-13)16-5-4-6-17-20(16)21(23)26-22(25-17)31-15-9-7-14(8-10-15)24-19(30)12-29(2)3/h4-11H,12H2,1-3H3,(H,24,30)(H,27,28)(H2,23,25,26)