N-[(2S)-1-azanyl-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-5-(pyrimidin-2-ylamino)pentanamide

Systemtic Name: N-[(2S)-1-azanyl-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-5-(pyrimidin-2-ylamino)pentanamide Openeye Name: N-[(1S)-2-amino-1-(2-naphthylmethyl)-2-oxo-ethyl]-5-(pyrimidin-2-ylamino)pentanamide CAS Name: N-[(2S)-1-amino-3-(2-naphthalenyl)-1-oxopropan-2-yl]-5-(2-pyrimidinylamino)pentanamide IUPAC Name: N-[(2S)-1-amino-3-naphthalen-2-yl-1-oxopropan-2-yl]-5-(pyrimidin-2-ylamino)pentanamide Traditional Name: N-[(1S)-2-amino-2-keto-1-(2-naphthylmethyl)ethyl]-5-(2-pyrimidylamino)valeramide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(C(=O)N)NC(=O)CCCCNC3=NC=CC=N3

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C[C@@H](C(=O)N)NC(=O)CCCCNC3=NC=CC=N3

InChI

InChI=1S/C22H25N5O2/c23-21(29)19(15-16-9-10-17-6-1-2-7-18(17)14-16)27-20(28)8-3-4-11-24-22-25-12-5-13-26-22/h1-2,5-7,9-10,12-14,19H,3-4,8,11,15H2,(H2,23,29)(H,27,28)(H,24,25,26)/t19-/m0/s1