4-methyl-2-[[6-methyl-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-methyl-2-[[6-methyl-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-methyl-2-[[6-methyl-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]thiazole-5-carboxylic acid CAS Name: 4-methyl-2-[[6-methyl-7-[3-(4-morpholinyl)propoxy]-4-quinazolinyl]amino]-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-[[6-methyl-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]-1,3-thiazole-5-carboxylic acid Traditional Name: 4-methyl-2-[[6-methyl-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]thiazole-5-carboxylic acid Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC=N2)NC3=NC(=C(S3)C(=O)O)C)OCCCN4CCOCC4

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC=N2)NC3=NC(=C(S3)C(=O)O)C)OCCCN4CCOCC4

InChI

InChI=1S/C21H25N5O4S/c1-13-10-15-16(11-17(13)30-7-3-4-26-5-8-29-9-6-26)22-12-23-19(15)25-21-24-14(2)18(31-21)20(27)28/h10-12H,3-9H2,1-2H3,(H,27,28)(H,22,23,24,25)