ethyl 3-[[4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-pyridin-2-yl]piperidin-1-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-[[4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-pyridin-2-yl]piperidin-1-yl]carbonylamino]propanoate Openeye Name: ethyl 3-[[4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-2-pyridyl]piperidine-1-carbonyl]amino]propanoate CAS Name: 3-[[[4-[3-[[4-(1-imidazolyl)anilino]-oxomethyl]-6-methyl-2-pyridinyl]-1-piperidinyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methylpyridin-2-yl]piperidine-1-carbonyl]amino]propanoate Traditional Name: 3-[[4-[3-[(4-imidazol-1-ylphenyl)carbamoyl]-6-methyl-2-pyridyl]piperidine-1-carbonyl]amino]propionic acid ethyl ester Formula: C27H32N6O4 MolecularWeight: 504.58078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CCOC(=O)CCNC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C27H32N6O4/c1-3-37-24(34)10-13-29-27(36)32-15-11-20(12-16-32)25-23(9-4-19(2)30-25)26(35)31-21-5-7-22(8-6-21)33-17-14-28-18-33/h4-9,14,17-18,20H,3,10-13,15-16H2,1-2H3,(H,29,36)(H,31,35)