(2S)-N-[(2S,3R)-4-[(4-ethenylphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-2-[3-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxidanylidene-imidazolidin-1-yl]butanamide

Systemtic Name: (2S)-N-[(2S,3R)-4-[(4-ethenylphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-2-[3-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxidanylidene-imidazolidin-1-yl]butanamide Openeye Name: (2S)-N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-(4-vinylphenyl)sulfonyl-amino]propyl]-3-methyl-2-[3-[(2-methylthiazol-4-yl)methyl]-2-oxo-imidazolidin-1-yl]butanamide CAS Name: (2S)-N-[(2S,3R)-4-[(4-ethenylphenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-3-methyl-2-[3-[(2-methyl-4-thiazolyl)methyl]-2-oxo-1-imidazolidinyl]butanamide IUPAC Name: (2S)-N-[(2S,3R)-4-[(4-ethenylphenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-3-methyl-2-[3-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxoimidazolidin-1-yl]butanamide Traditional Name: (2S)-N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-(4-vinylphenyl)sulfonyl-amino]propyl]-2-[2-keto-3-[(2-methylthiazol-4-yl)methyl]imidazolidin-1-yl]-3-methyl-butyramide Formula: C35H47N5O5S2 MolecularWeight: 681.90818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCN(C2=O)C(C(C)C)C(=O)NC(CC3=CC=CC=C3)C(CN(CC(C)C)S(=O)(=O)C4=CC=C(C=C4)C=C)O

Isomeric SMILES

CC1=NC(=CS1)CN2CCN(C2=O)[C@@H](C(C)C)C(=O)N[C@@H](CC3=CC=CC=C3)[C@@H](CN(CC(C)C)S(=O)(=O)C4=CC=C(C=C4)C=C)O

InChI

InChI=1S/C35H47N5O5S2/c1-7-27-13-15-30(16-14-27)47(44,45)39(20-24(2)3)22-32(41)31(19-28-11-9-8-10-12-28)37-34(42)33(25(4)5)40-18-17-38(35(40)43)21-29-23-46-26(6)36-29/h7-16,23-25,31-33,41H,1,17-22H2,2-6H3,(H,37,42)/t31-,32+,33-/m0/s1