1-(3-azanyl-5-methyl-pyrazol-1-yl)-2-[4-(oxolan-2-ylmethylamino)quinazolin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3-azanyl-5-methyl-pyrazol-1-yl)-2-[4-(oxolan-2-ylmethylamino)quinazolin-2-yl]sulfanyl-ethanone Openeye Name: 1-(3-amino-5-methyl-pyrazol-1-yl)-2-[4-(tetrahydrofuran-2-ylmethylamino)quinazolin-2-yl]sulfanyl-ethanone CAS Name: 1-(3-amino-5-methyl-1-pyrazolyl)-2-[[4-(2-oxolanylmethylamino)-2-quinazolinyl]thio]ethanone IUPAC Name: 1-(3-amino-5-methylpyrazol-1-yl)-2-[4-(oxolan-2-ylmethylamino)quinazolin-2-yl]sulfanylethanone Traditional Name: 1-(3-amino-5-methyl-pyrazol-1-yl)-2-[[4-(tetrahydrofurfurylamino)quinazolin-2-yl]thio]ethanone Formula: C19H22N6O2S MolecularWeight: 398.48198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC4CCCO4)N

Isomeric SMILES

CC1=CC(=NN1C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC4CCCO4)N

InChI

InChI=1S/C19H22N6O2S/c1-12-9-16(20)24-25(12)17(26)11-28-19-22-15-7-3-2-6-14(15)18(23-19)21-10-13-5-4-8-27-13/h2-3,6-7,9,13H,4-5,8,10-11H2,1H3,(H2,20,24)(H,21,22,23)