N-[(2S)-2-azanyl-3-phenyl-propanoyl]-2-methanethioyl-4-phenyl-butanamide

Systemtic Name: N-[(2S)-2-azanyl-3-phenyl-propanoyl]-2-methanethioyl-4-phenyl-butanamide Openeye Name: N-[(2S)-2-amino-3-phenyl-propanoyl]-2-methanethioyl-4-phenyl-butanamide CAS Name: N-[(2S)-2-amino-1-oxo-3-phenylpropyl]-2-methanethioyl-4-phenylbutanamide IUPAC Name: N-[(2S)-2-amino-3-phenylpropanoyl]-2-methanethioyl-4-phenylbutanamide Traditional Name: N-[(2S)-2-amino-3-phenyl-propanoyl]-4-phenyl-2-thioformyl-butyramide Formula: C20H22N2O2S MolecularWeight: 354.46588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C=S)C(=O)NC(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

C1=CC=C(C=C1)CCC(C=S)C(=O)NC(=O)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C20H22N2O2S/c21-18(13-16-9-5-2-6-10-16)20(24)22-19(23)17(14-25)12-11-15-7-3-1-4-8-15/h1-10,14,17-18H,11-13,21H2,(H,22,23,24)/t17?,18-/m0/s1