[2-[2-[3-bromanyl-5-(phenylcarbamoyl)-2H-pyridin-1-yl]ethoxycarbonylamino]-1-phenyl-ethyl] N-butylcarbamate

Systemtic Name: [2-[2-[3-bromanyl-5-(phenylcarbamoyl)-2H-pyridin-1-yl]ethoxycarbonylamino]-1-phenyl-ethyl] N-butylcarbamate Openeye Name: [2-[2-[3-bromo-5-(phenylcarbamoyl)-2H-pyridin-1-yl]ethoxycarbonylamino]-1-phenyl-ethyl] N-butylcarbamate CAS Name: N-butylcarbamic acid [2-[[2-[5-[anilino(oxo)methyl]-3-bromo-2H-pyridin-1-yl]ethoxy-oxomethyl]amino]-1-phenylethyl] ester IUPAC Name: [2-[2-[3-bromo-5-(phenylcarbamoyl)-2H-pyridin-1-yl]ethoxycarbonylamino]-1-phenylethyl] N-butylcarbamate Traditional Name: N-butylcarbamic acid [2-[2-[3-bromo-5-(phenylcarbamoyl)-2H-pyridin-1-yl]ethoxycarbonylamino]-1-phenyl-ethyl] ester Formula: C28H33BrN4O5 MolecularWeight: 585.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)OC(CNC(=O)OCCN1CC(=CC(=C1)C(=O)NC2=CC=CC=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)OC(CNC(=O)OCCN1CC(=CC(=C1)C(=O)NC2=CC=CC=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C28H33BrN4O5/c1-2-3-14-30-28(36)38-25(21-10-6-4-7-11-21)18-31-27(35)37-16-15-33-19-22(17-23(29)20-33)26(34)32-24-12-8-5-9-13-24/h4-13,17,19,25H,2-3,14-16,18,20H2,1H3,(H,30,36)(H,31,35)(H,32,34)