3-ethylsulfanyl-5-methoxy-2-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]benzene-1,4-diol

Systemtic Name: 3-ethylsulfanyl-5-methoxy-2-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]benzene-1,4-diol Openeye Name: 3-ethylsulfanyl-5-methoxy-2-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]benzene-1,4-diol CAS Name: 3-(ethylthio)-5-methoxy-2-[[6-methoxy-7-(2-methoxyethoxy)-4-quinazolinyl]amino]benzene-1,4-diol IUPAC Name: 3-ethylsulfanyl-5-methoxy-2-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]benzene-1,4-diol Traditional Name: 3-(ethylthio)-5-methoxy-2-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]hydroquinone Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=CC(=C1O)OC)O)NC2=NC=NC3=CC(=C(C=C32)OC)OCCOC

Isomeric SMILES

CCSC1=C(C(=CC(=C1O)OC)O)NC2=NC=NC3=CC(=C(C=C32)OC)OCCOC

InChI

InChI=1S/C21H25N3O6S/c1-5-31-20-18(14(25)10-17(29-4)19(20)26)24-21-12-8-15(28-3)16(30-7-6-27-2)9-13(12)22-11-23-21/h8-11,25-26H,5-7H2,1-4H3,(H,22,23,24)