(phenylmethyl) 4-[4-[5-[(1-ethyl-4-methoxy-indol-2-yl)carbonylamino]pyridin-2-yl]piperazin-1-yl]carbonylcyclohexane-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-[5-[(1-ethyl-4-methoxy-indol-2-yl)carbonylamino]pyridin-2-yl]piperazin-1-yl]carbonylcyclohexane-1-carboxylate Openeye Name: benzyl 4-[4-[5-[(1-ethyl-4-methoxy-indole-2-carbonyl)amino]-2-pyridyl]piperazine-1-carbonyl]cyclohexanecarboxylate CAS Name: 4-[[4-[5-[[(1-ethyl-4-methoxy-2-indolyl)-oxomethyl]amino]-2-pyridinyl]-1-piperazinyl]-oxomethyl]-1-cyclohexanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-[5-[(1-ethyl-4-methoxyindole-2-carbonyl)amino]pyridin-2-yl]piperazine-1-carbonyl]cyclohexane-1-carboxylate Traditional Name: 4-[4-[5-[(1-ethyl-4-methoxy-indole-2-carbonyl)amino]-2-pyridyl]piperazine-1-carbonyl]cyclohexanecarboxylic acid benzyl ester Formula: C36H41N5O5 MolecularWeight: 623.74124

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C1C(=O)NC3=CN=C(C=C3)N4CCN(CC4)C(=O)C5CCC(CC5)C(=O)OCC6=CC=CC=C6)C(=CC=C2)OC

Isomeric SMILES

CCN1C2=C(C=C1C(=O)NC3=CN=C(C=C3)N4CCN(CC4)C(=O)C5CCC(CC5)C(=O)OCC6=CC=CC=C6)C(=CC=C2)OC

InChI

InChI=1S/C36H41N5O5/c1-3-41-30-10-7-11-32(45-2)29(30)22-31(41)34(42)38-28-16-17-33(37-23-28)39-18-20-40(21-19-39)35(43)26-12-14-27(15-13-26)36(44)46-24-25-8-5-4-6-9-25/h4-11,16-17,22-23,26-27H,3,12-15,18-21,24H2,1-2H3,(H,38,42)