2-azanyl-N-[1-oxidanylidene-1-(phenethylamino)-3-phenyl-propan-2-yl]butanediamide hydrobromide

Systemtic Name: 2-azanyl-N-[1-oxidanylidene-1-(phenethylamino)-3-phenyl-propan-2-yl]butanediamide hydrobromide Openeye Name: 2-amino-N-[1-benzyl-2-oxo-2-(phenethylamino)ethyl]butanediamide hydrobromide CAS Name: 2-amino-N-[1-oxo-1-(phenethylamino)-3-phenylpropan-2-yl]butanediamide hydrobromide IUPAC Name: 2-amino-N-[1-oxo-1-(phenethylamino)-3-phenylpropan-2-yl]butanediamide hydrobromide Traditional Name: 2-amino-N-[1-benzyl-2-keto-2-(phenethylamino)ethyl]succinamide hydrobromide Formula: C21H27BrN4O3 MolecularWeight: 463.36808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(=O)N)N.Br

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(=O)N)N.Br

InChI

InChI=1S/C21H26N4O3.BrH/c22-17(14-19(23)26)20(27)25-18(13-16-9-5-2-6-10-16)21(28)24-12-11-15-7-3-1-4-8-15;/h1-10,17-18H,11-14,22H2,(H2,23,26)(H,24,28)(H,25,27);1H