6-methoxy-7-[3-(4-prop-2-ynylpiperazin-1-yl)propoxy]-4-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)quinazoline

Systemtic Name: 6-methoxy-7-[3-(4-prop-2-ynylpiperazin-1-yl)propoxy]-4-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)quinazoline Openeye Name: 6-methoxy-7-[3-(4-prop-2-ynylpiperazin-1-yl)propoxy]-4-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)quinazoline CAS Name: 6-methoxy-7-[3-(4-prop-2-ynyl-1-piperazinyl)propoxy]-4-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)quinazoline IUPAC Name: 6-methoxy-7-[3-(4-prop-2-ynylpiperazin-1-yl)propoxy]-4-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)quinazoline Traditional Name: 6-methoxy-7-[3-(4-propargylpiperazino)propoxy]-4-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)quinazoline Formula: C26H28N6O3 MolecularWeight: 472.53892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CN=C4C(=C3)C=CN4)OCCCN5CCN(CC5)CC#C

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CN=C4C(=C3)C=CN4)OCCCN5CCN(CC5)CC#C

InChI

InChI=1S/C26H28N6O3/c1-3-7-31-9-11-32(12-10-31)8-4-13-34-24-16-22-21(15-23(24)33-2)26(30-18-29-22)35-20-14-19-5-6-27-25(19)28-17-20/h1,5-6,14-18H,4,7-13H2,2H3,(H,27,28)