[6-[(4,6-dimethylpyrimidin-5-yl)amino]-5-phenyl-hexyl] 4-(morpholin-4-ylmethyl)benzoate

Systemtic Name: [6-[(4,6-dimethylpyrimidin-5-yl)amino]-5-phenyl-hexyl] 4-(morpholin-4-ylmethyl)benzoate Openeye Name: [6-[(4,6-dimethylpyrimidin-5-yl)amino]-5-phenyl-hexyl] 4-(morpholinomethyl)benzoate CAS Name: 4-(4-morpholinylmethyl)benzoic acid [6-[(4,6-dimethyl-5-pyrimidinyl)amino]-5-phenylhexyl] ester IUPAC Name: [6-[(4,6-dimethylpyrimidin-5-yl)amino]-5-phenylhexyl] 4-(morpholin-4-ylmethyl)benzoate Traditional Name: 4-(morpholinomethyl)benzoic acid [6-[(4,6-dimethylpyrimidin-5-yl)amino]-5-phenyl-hexyl] ester Formula: C30H38N4O3 MolecularWeight: 502.64772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=N1)C)NCC(CCCCOC(=O)C2=CC=C(C=C2)CN3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NC=N1)C)NCC(CCCCOC(=O)C2=CC=C(C=C2)CN3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C30H38N4O3/c1-23-29(24(2)33-22-32-23)31-20-28(26-8-4-3-5-9-26)10-6-7-17-37-30(35)27-13-11-25(12-14-27)21-34-15-18-36-19-16-34/h3-5,8-9,11-14,22,28,31H,6-7,10,15-21H2,1-2H3