ethyl 4-[[2-azanyl-5-(3-morpholin-4-ylpropoxy)phenyl]methylamino]-2-pyridin-4-yl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-[[2-azanyl-5-(3-morpholin-4-ylpropoxy)phenyl]methylamino]-2-pyridin-4-yl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[[2-amino-5-(3-morpholinopropoxy)phenyl]methylamino]-2-(4-pyridyl)thiazole-5-carboxylate CAS Name: 4-[[2-amino-5-[3-(4-morpholinyl)propoxy]phenyl]methylamino]-2-pyridin-4-yl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-amino-5-(3-morpholin-4-ylpropoxy)phenyl]methylamino]-2-pyridin-4-yl-1,3-thiazole-5-carboxylate Traditional Name: 4-[[2-amino-5-(3-morpholinopropoxy)benzyl]amino]-2-(4-pyridyl)thiazole-5-carboxylic acid ethyl ester Formula: C25H31N5O4S MolecularWeight: 497.60974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)C2=CC=NC=C2)NCC3=C(C=CC(=C3)OCCCN4CCOCC4)N

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C2=CC=NC=C2)NCC3=C(C=CC(=C3)OCCCN4CCOCC4)N

InChI

InChI=1S/C25H31N5O4S/c1-2-33-25(31)22-23(29-24(35-22)18-6-8-27-9-7-18)28-17-19-16-20(4-5-21(19)26)34-13-3-10-30-11-14-32-15-12-30/h4-9,16,28H,2-3,10-15,17,26H2,1H3