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

Systemtic Name: N-[4-[4-azanyl-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]-3-(dimethylamino)propanamide Openeye Name: N-[4-[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]-3-(dimethylamino)propanamide CAS Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-2-quinazolinyl]thio]phenyl]-3-(dimethylamino)propanamide IUPAC Name: N-[4-[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]sulfanylphenyl]-3-(dimethylamino)propanamide Traditional Name: N-[4-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)quinazolin-2-yl]thio]phenyl]-3-(dimethylamino)propionamide Formula: C23H25N7OS MolecularWeight: 447.5559

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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)CCN(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25N7OS/c1-14-13-19(29-28-14)17-5-4-6-18-21(17)22(24)27-23(26-18)32-16-9-7-15(8-10-16)25-20(31)11-12-30(2)3/h4-10,13H,11-12H2,1-3H3,(H,25,31)(H,28,29)(H2,24,26,27)