6-ethynyl-7-methoxy-N-(4-morpholin-4-ylsulfonylphenyl)quinazolin-2-amine

Systemtic Name: 6-ethynyl-7-methoxy-N-(4-morpholin-4-ylsulfonylphenyl)quinazolin-2-amine Openeye Name: 6-ethynyl-7-methoxy-N-(4-morpholinosulfonylphenyl)quinazolin-2-amine CAS Name: 6-ethynyl-7-methoxy-N-[4-(4-morpholinylsulfonyl)phenyl]-2-quinazolinamine IUPAC Name: 6-ethynyl-7-methoxy-N-(4-morpholin-4-ylsulfonylphenyl)quinazolin-2-amine Traditional Name: (6-ethynyl-7-methoxy-quinazolin-2-yl)-(4-morpholinosulfonylphenyl)amine Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=NC=C2C=C1C#C)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC2=NC(=NC=C2C=C1C#C)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H20N4O4S/c1-3-15-12-16-14-22-21(24-19(16)13-20(15)28-2)23-17-4-6-18(7-5-17)30(26,27)25-8-10-29-11-9-25/h1,4-7,12-14H,8-11H2,2H3,(H,22,23,24)