methyl 5-methylsulfonyl-2-[4-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]quinazolin-6-yl]oxy-benzoate

Systemtic Name: methyl 5-methylsulfonyl-2-[4-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]quinazolin-6-yl]oxy-benzoate Openeye Name: methyl 5-methylsulfonyl-2-[4-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]quinazolin-6-yl]oxy-benzoate CAS Name: 5-methylsulfonyl-2-[[4-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]-6-quinazolinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 5-methylsulfonyl-2-[4-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]quinazolin-6-yl]oxybenzoate Traditional Name: 5-mesyl-2-[4-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]quinazolin-6-yl]oxy-benzoic acid methyl ester Formula: C20H17N5O5S2 MolecularWeight: 471.50948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=N1)NC2=NC=NC3=C2C=C(C=C3)OC4=C(C=C(C=C4)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC1=NSC(=N1)NC2=NC=NC3=C2C=C(C=C3)OC4=C(C=C(C=C4)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C20H17N5O5S2/c1-11-23-20(31-25-11)24-18-14-8-12(4-6-16(14)21-10-22-18)30-17-7-5-13(32(3,27)28)9-15(17)19(26)29-2/h4-10H,1-3H3,(H,21,22,23,24,25)