2-[(9-ethylcarbazol-3-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazine-1-carboxylate

Systemtic Name: 2-[(9-ethylcarbazol-3-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazine-1-carboxylate Openeye Name: 2-[tert-butoxycarbonyl-[(9-ethylcarbazol-3-yl)methyl]amino]ethyl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-piperazinecarboxylic acid 2-[(9-ethyl-3-carbazolyl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl ester IUPAC Name: 2-[(9-ethylcarbazol-3-yl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl 4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazine-1-carboxylic acid 2-[tert-butoxycarbonyl-[(9-ethylcarbazol-3-yl)methyl]amino]ethyl ester Formula: C39H48N6O4 MolecularWeight: 664.83622

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN(CCOC(=O)N3CCN(CC3)CC4=C(N(N=C4C)C5=CC=CC=C5)C)C(=O)OC(C)(C)C)C6=CC=CC=C61

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN(CCOC(=O)N3CCN(CC3)CC4=C(N(N=C4C)C5=CC=CC=C5)C)C(=O)OC(C)(C)C)C6=CC=CC=C61

InChI

InChI=1S/C39H48N6O4/c1-7-44-35-16-12-11-15-32(35)33-25-30(17-18-36(33)44)26-43(38(47)49-39(4,5)6)23-24-48-37(46)42-21-19-41(20-22-42)27-34-28(2)40-45(29(34)3)31-13-9-8-10-14-31/h8-18,25H,7,19-24,26-27H2,1-6H3