(2S)-2-azanyl-N-[(2S)-3-(1H-imidazol-5-yl)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]-3-phenyl-propanamide

Systemtic Name: (2S)-2-azanyl-N-[(2S)-3-(1H-imidazol-5-yl)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]-3-phenyl-propanamide Openeye Name: (2S)-2-amino-N-[(1S)-1-(1H-imidazol-5-ylmethyl)-2-(2-naphthylamino)-2-oxo-ethyl]-3-phenyl-propanamide CAS Name: (2S)-2-amino-N-[(2S)-3-(1H-imidazol-5-yl)-1-(2-naphthalenylamino)-1-oxopropan-2-yl]-3-phenylpropanamide IUPAC Name: (2S)-2-amino-N-[(2S)-3-(1H-imidazol-5-yl)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]-3-phenylpropanamide Traditional Name: (2S)-2-amino-N-[(1S)-1-(1H-imidazol-5-ylmethyl)-2-keto-2-(2-naphthylamino)ethyl]-3-phenyl-propionamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC2=CN=CN2)C(=O)NC3=CC4=CC=CC=C4C=C3)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CC2=CN=CN2)C(=O)NC3=CC4=CC=CC=C4C=C3)N

InChI

InChI=1S/C25H25N5O2/c26-22(12-17-6-2-1-3-7-17)24(31)30-23(14-21-15-27-16-28-21)25(32)29-20-11-10-18-8-4-5-9-19(18)13-20/h1-11,13,15-16,22-23H,12,14,26H2,(H,27,28)(H,29,32)(H,30,31)/t22-,23-/m0/s1