N-tert-butyl-2-[[2-(3-methylbutylamino)-3-pyridin-4-yl-propanoyl]amino]-3-[4-(phenylcarbonyloxy)phenyl]propanimidate

Systemtic Name: N-tert-butyl-2-[[2-(3-methylbutylamino)-3-pyridin-4-yl-propanoyl]amino]-3-[4-(phenylcarbonyloxy)phenyl]propanimidate Openeye Name: 3-(4-benzoyloxyphenyl)-N-tert-butyl-2-[[2-(isopentylamino)-3-(4-pyridyl)propanoyl]amino]propanimidate CAS Name: 3-(4-benzoyloxyphenyl)-N-tert-butyl-2-[[2-(3-methylbutylamino)-1-oxo-3-pyridin-4-ylpropyl]amino]propanimidate IUPAC Name: 3-(4-benzoyloxyphenyl)-N-tert-butyl-2-[[2-(3-methylbutylamino)-3-pyridin-4-ylpropanoyl]amino]propanimidate Traditional Name: 3-(4-benzoyloxyphenyl)-N-tert-butyl-2-[[2-(isoamylamino)-3-(4-pyridyl)propanoyl]amino]propionimidate Formula: C33H41N4O4- MolecularWeight: 557.70304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(CC1=CC=NC=C1)C(=O)NC(CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C(=NC(C)(C)C)[O-]

Isomeric SMILES

CC(C)CCNC(CC1=CC=NC=C1)C(=O)NC(CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C(=NC(C)(C)C)[O-]

InChI

InChI=1S/C33H42N4O4/c1-23(2)15-20-35-28(21-25-16-18-34-19-17-25)30(38)36-29(31(39)37-33(3,4)5)22-24-11-13-27(14-12-24)41-32(40)26-9-7-6-8-10-26/h6-14,16-19,23,28-29,35H,15,20-22H2,1-5H3,(H,36,38)(H,37,39)/p-1