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

Systemtic Name: ethyl 4-[[2-azanyl-4-(morpholin-4-ylmethyl)phenyl]methylamino]-2-pyridin-3-yl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[[2-amino-4-(morpholinomethyl)phenyl]methylamino]-2-(3-pyridyl)thiazole-5-carboxylate CAS Name: 4-[[2-amino-4-(4-morpholinylmethyl)phenyl]methylamino]-2-(3-pyridinyl)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-amino-4-(morpholin-4-ylmethyl)phenyl]methylamino]-2-pyridin-3-yl-1,3-thiazole-5-carboxylate Traditional Name: 4-[[2-amino-4-(morpholinomethyl)benzyl]amino]-2-(3-pyridyl)thiazole-5-carboxylic acid ethyl ester Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)C2=CN=CC=C2)NCC3=C(C=C(C=C3)CN4CCOCC4)N

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C2=CN=CC=C2)NCC3=C(C=C(C=C3)CN4CCOCC4)N

InChI

InChI=1S/C23H27N5O3S/c1-2-31-23(29)20-21(27-22(32-20)18-4-3-7-25-13-18)26-14-17-6-5-16(12-19(17)24)15-28-8-10-30-11-9-28/h3-7,12-13,26H,2,8-11,14-15,24H2,1H3