2-[(2-azanyl-3-pyridin-3-yl-propanoyl)amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate

Systemtic Name: 2-[(2-azanyl-3-pyridin-3-yl-propanoyl)amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate Openeye Name: 2-[[2-amino-3-(3-pyridyl)propanoyl]amino]-3-(4-benzyloxyphenyl)-N-tert-butyl-propanimidate CAS Name: 2-[[2-amino-1-oxo-3-(3-pyridinyl)propyl]amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate IUPAC Name: 2-[(2-amino-3-pyridin-3-ylpropanoyl)amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate Traditional Name: 2-[[2-amino-3-(3-pyridyl)propanoyl]amino]-3-(4-benzoxyphenyl)-N-tert-butyl-propionimidate Formula: C28H33N4O3- MolecularWeight: 473.58662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC3=CN=CC=C3)N)[O-]

Isomeric SMILES

CC(C)(C)N=C(C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC3=CN=CC=C3)N)[O-]

InChI

InChI=1S/C28H34N4O3/c1-28(2,3)32-27(34)25(31-26(33)24(29)16-22-10-7-15-30-18-22)17-20-11-13-23(14-12-20)35-19-21-8-5-4-6-9-21/h4-15,18,24-25H,16-17,19,29H2,1-3H3,(H,31,33)(H,32,34)/p-1