5-methoxy-3-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]-2-pyridin-2-ylsulfanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 5-methoxy-3-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]-2-pyridin-2-ylsulfanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-methoxy-3-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]-2-(2-pyridylsulfanyl)-1,4-benzoquinone CAS Name: 5-methoxy-3-[[6-methoxy-7-(2-methoxyethoxy)-4-quinazolinyl]amino]-2-(2-pyridinylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-methoxy-3-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]-2-pyridin-2-ylsulfanylcyclohexa-2,5-diene-1,4-dione Traditional Name: 5-methoxy-3-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]-2-(2-pyridylthio)-p-benzoquinone Formula: C24H22N4O6S MolecularWeight: 494.51968

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=O)C=C(C3=O)OC)SC4=CC=CC=N4)OC

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=O)C=C(C3=O)OC)SC4=CC=CC=N4)OC

InChI

InChI=1S/C24H22N4O6S/c1-31-8-9-34-18-11-15-14(10-17(18)32-2)24(27-13-26-15)28-21-22(30)19(33-3)12-16(29)23(21)35-20-6-4-5-7-25-20/h4-7,10-13H,8-9H2,1-3H3,(H,26,27,28)