(2S)-2-azanyl-N-[(2S)-1-[[(2R)-2-azanyl-3-phenyl-propyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-[(2S)-1-[[(2R)-2-azanyl-3-phenyl-propyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-amino-N-[(1S)-2-[[(2R)-2-amino-3-phenyl-propyl]amino]-1-benzyl-2-oxo-ethyl]-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-[(2S)-1-[[(2R)-2-amino-3-phenylpropyl]amino]-1-oxo-3-phenylpropan-2-yl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-[(2S)-1-[[(2R)-2-amino-3-phenylpropyl]amino]-1-oxo-3-phenylpropan-2-yl]-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-N-[(1S)-2-[[(2R)-2-amino-3-phenyl-propyl]amino]-1-benzyl-2-keto-ethyl]-4-(methylthio)butyramide Formula: C23H32N4O2S MolecularWeight: 428.59078

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC(CC1=CC=CC=C1)C(=O)NCC(CC2=CC=CC=C2)N)N

Isomeric SMILES

CSCC[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC[C@@H](CC2=CC=CC=C2)N)N

InChI

InChI=1S/C23H32N4O2S/c1-30-13-12-20(25)22(28)27-21(15-18-10-6-3-7-11-18)23(29)26-16-19(24)14-17-8-4-2-5-9-17/h2-11,19-21H,12-16,24-25H2,1H3,(H,26,29)(H,27,28)/t19-,20+,21+/m1/s1