N-(4-ethoxy-3-morpholin-4-ylsulfonyl-phenyl)-2-pyridin-3-yl-quinazolin-4-amine

Systemtic Name: N-(4-ethoxy-3-morpholin-4-ylsulfonyl-phenyl)-2-pyridin-3-yl-quinazolin-4-amine Openeye Name: N-(4-ethoxy-3-morpholinosulfonyl-phenyl)-2-(3-pyridyl)quinazolin-4-amine CAS Name: N-[4-ethoxy-3-(4-morpholinylsulfonyl)phenyl]-2-(3-pyridinyl)-4-quinazolinamine IUPAC Name: N-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)-2-pyridin-3-ylquinazolin-4-amine Traditional Name: (4-ethoxy-3-morpholinosulfonyl-phenyl)-[2-(3-pyridyl)quinazolin-4-yl]amine Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H25N5O4S/c1-2-34-22-10-9-19(16-23(22)35(31,32)30-12-14-33-15-13-30)27-25-20-7-3-4-8-21(20)28-24(29-25)18-6-5-11-26-17-18/h3-11,16-17H,2,12-15H2,1H3,(H,27,28,29)