2-[(6-ethylquinazolin-4-yl)amino]-4-ethylsulfonyl-phenol

Systemtic Name: 2-[(6-ethylquinazolin-4-yl)amino]-4-ethylsulfonyl-phenol Openeye Name: 2-[(6-ethylquinazolin-4-yl)amino]-4-ethylsulfonyl-phenol CAS Name: 2-[(6-ethyl-4-quinazolinyl)amino]-4-ethylsulfonylphenol IUPAC Name: 2-[(6-ethylquinazolin-4-yl)amino]-4-ethylsulfonylphenol Traditional Name: 4-esyl-2-[(6-ethylquinazolin-4-yl)amino]phenol Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=CN=C2NC3=C(C=CC(=C3)S(=O)(=O)CC)O

Isomeric SMILES

CCC1=CC2=C(C=C1)N=CN=C2NC3=C(C=CC(=C3)S(=O)(=O)CC)O

InChI

InChI=1S/C18H19N3O3S/c1-3-12-5-7-15-14(9-12)18(20-11-19-15)21-16-10-13(6-8-17(16)22)25(23,24)4-2/h5-11,22H,3-4H2,1-2H3,(H,19,20,21)