(2S)-4-azanyl-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-2-[(4-ethylnaphthalen-1-yl)sulfonylamino]butanamide

Systemtic Name: (2S)-4-azanyl-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-2-[(4-ethylnaphthalen-1-yl)sulfonylamino]butanamide Openeye Name: (2S)-4-amino-N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-2-[(4-ethyl-1-naphthyl)sulfonylamino]butanamide CAS Name: (2S)-4-amino-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-[(4-ethyl-1-naphthalenyl)sulfonylamino]butanamide IUPAC Name: (2S)-4-amino-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-[(4-ethylnaphthalen-1-yl)sulfonylamino]butanamide Traditional Name: (2S)-4-amino-N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-2-[(4-ethyl-1-naphthyl)sulfonylamino]butyramide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C2=CC=CC=C12)S(=O)(=O)NC(CCN)C(=O)NC(CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CCC1=CC=C(C2=CC=CC=C12)S(=O)(=O)N[C@@H](CCN)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C25H30N4O4S/c1-2-18-12-13-23(20-11-7-6-10-19(18)20)34(32,33)29-21(14-15-26)25(31)28-22(24(27)30)16-17-8-4-3-5-9-17/h3-13,21-22,29H,2,14-16,26H2,1H3,(H2,27,30)(H,28,31)/t21-,22-/m0/s1