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

Systemtic Name: 2-methyl-N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]sulfanylphenyl]propanamide Openeye Name: 2-methyl-N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]sulfanylphenyl]propanamide CAS Name: 2-methyl-N-[4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-quinazolinyl]thio]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]sulfanylphenyl]propanamide Traditional Name: 2-methyl-N-[4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]thio]phenyl]propionamide Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)NC(=O)C(C)C

Isomeric SMILES

CC1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)NC(=O)C(C)C

InChI

InChI=1S/C22H22N6OS/c1-13(2)21(29)23-15-8-10-16(11-9-15)30-22-24-18-7-5-4-6-17(18)20(26-22)25-19-12-14(3)27-28-19/h4-13H,1-3H3,(H,23,29)(H2,24,25,26,27,28)