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

Systemtic Name: (3S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-4-phenyl-3-(thiophen-3-ylmethylamino)butanamide Openeye Name: (3S)-N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-4-phenyl-3-(3-thienylmethylamino)butanamide CAS Name: (3S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-4-phenyl-3-(3-thiophenylmethylamino)butanamide IUPAC Name: (3S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-4-phenyl-3-(thiophen-3-ylmethylamino)butanamide Traditional Name: (3S)-N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-4-phenyl-3-(3-thenylamino)butyramide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)NC(CC2=CC=CC=C2)C(=O)N)NCC3=CSC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](CC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N)NCC3=CSC=C3

InChI

InChI=1S/C24H27N3O2S/c25-24(29)22(14-19-9-5-2-6-10-19)27-23(28)15-21(13-18-7-3-1-4-8-18)26-16-20-11-12-30-17-20/h1-12,17,21-22,26H,13-16H2,(H2,25,29)(H,27,28)/t21-,22-/m0/s1