N-[6-[[(2S)-2-azanyl-3-phenyl-propyl]amino]-1-methyl-2-oxidanylidene-4-pyridin-4-yl-pyridin-3-yl]benzamide

Systemtic Name: N-[6-[[(2S)-2-azanyl-3-phenyl-propyl]amino]-1-methyl-2-oxidanylidene-4-pyridin-4-yl-pyridin-3-yl]benzamide Openeye Name: N-[6-[[(2S)-2-amino-3-phenyl-propyl]amino]-1-methyl-2-oxo-4-(4-pyridyl)-3-pyridyl]benzamide CAS Name: N-[6-[[(2S)-2-amino-3-phenylpropyl]amino]-1-methyl-2-oxo-4-pyridin-4-yl-3-pyridinyl]benzamide IUPAC Name: N-[6-[[(2S)-2-amino-3-phenylpropyl]amino]-1-methyl-2-oxo-4-pyridin-4-ylpyridin-3-yl]benzamide Traditional Name: N-[6-[[(2S)-2-amino-3-phenyl-propyl]amino]-2-keto-1-methyl-4-(4-pyridyl)-3-pyridyl]benzamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C(C1=O)NC(=O)C2=CC=CC=C2)C3=CC=NC=C3)NCC(CC4=CC=CC=C4)N

Isomeric SMILES

CN1C(=CC(=C(C1=O)NC(=O)C2=CC=CC=C2)C3=CC=NC=C3)NC[C@H](CC4=CC=CC=C4)N

InChI

InChI=1S/C27H27N5O2/c1-32-24(30-18-22(28)16-19-8-4-2-5-9-19)17-23(20-12-14-29-15-13-20)25(27(32)34)31-26(33)21-10-6-3-7-11-21/h2-15,17,22,30H,16,18,28H2,1H3,(H,31,33)/t22-/m0/s1