N-[(2S)-4-acetamido-3-oxidanylidene-1-phenyl-butan-2-yl]-4-(naphthalen-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[(2S)-4-acetamido-3-oxidanylidene-1-phenyl-butan-2-yl]-4-(naphthalen-2-ylmethylsulfanyl)benzamide Openeye Name: N-[(1S)-3-acetamido-1-benzyl-2-oxo-propyl]-4-(2-naphthylmethylsulfanyl)benzamide CAS Name: N-[(2S)-4-acetamido-3-oxo-1-phenylbutan-2-yl]-4-(2-naphthalenylmethylthio)benzamide IUPAC Name: N-[(2S)-4-acetamido-3-oxo-1-phenylbutan-2-yl]-4-(naphthalen-2-ylmethylsulfanyl)benzamide Traditional Name: N-[(1S)-3-acetamido-1-benzyl-2-keto-propyl]-4-(2-naphthylmethylthio)benzamide Formula: C30H28N2O3S MolecularWeight: 496.61992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)SCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)NCC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)SCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C30H28N2O3S/c1-21(33)31-19-29(34)28(18-22-7-3-2-4-8-22)32-30(35)25-13-15-27(16-14-25)36-20-23-11-12-24-9-5-6-10-26(24)17-23/h2-17,28H,18-20H2,1H3,(H,31,33)(H,32,35)/t28-/m0/s1