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

Systemtic Name: 2-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]thiazole-5-carboxylic acid CAS Name: 2-[[6-methoxy-7-[3-(4-morpholinyl)propoxy]-4-quinazolinyl]amino]-5-thiazolecarboxylic acid IUPAC Name: 2-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]thiazole-5-carboxylic acid Formula: C20H23N5O5S MolecularWeight: 445.49212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=NC=C(S3)C(=O)O)OCCCN4CCOCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=NC=C(S3)C(=O)O)OCCCN4CCOCC4

InChI

InChI=1S/C20H23N5O5S/c1-28-15-9-13-14(10-16(15)30-6-2-3-25-4-7-29-8-5-25)22-12-23-18(13)24-20-21-11-17(31-20)19(26)27/h9-12H,2-8H2,1H3,(H,26,27)(H,21,22,23,24)