3-(3-methoxypropyl)-4-oxidanylidene-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(3-methoxypropyl)-4-oxidanylidene-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)-3-(3-methoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(3-methoxypropyl)-4-oxo-N-(1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(3-methoxypropyl)-4-oxo-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)-4-keto-3-(3-methoxypropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H24N6O3S MolecularWeight: 452.52936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCCOC

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCCOC

InChI

InChI=1S/C22H24N6O3S/c1-13(2)28-19-15(11-24-28)9-16(12-23-19)25-20(29)14-5-6-17-18(10-14)26-22(32)27(21(17)30)7-4-8-31-3/h5-6,9-13H,4,7-8H2,1-3H3,(H,25,29)(H,26,32)