(2S)-2-azanyl-N-[(2S)-1-[(2S)-2-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxidanylidene-3-[[(1S)-2-phenyl-1-(1,3-thiazol-5-yl)ethyl]amino]propyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-N,3-dimethyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-[(2S)-1-[(2S)-2-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxidanylidene-3-[[(1S)-2-phenyl-1-(1,3-thiazol-5-yl)ethyl]amino]propyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-N,3-dimethyl-butanamide Openeye Name: (2S)-2-amino-N-[(1S)-1-[(2S)-2-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-[[(1S)-2-phenyl-1-thiazol-5-yl-ethyl]amino]propyl]pyrrolidine-1-carbonyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]-N,3-dimethyl-butanamide CAS Name: (2S)-2-amino-N-[(2S)-1-[(2S)-2-[[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-[[(1S)-2-phenyl-1-(5-thiazolyl)ethyl]amino]propyl]-1-pyrrolidinyl]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]-N,3-dimethylbutanamide IUPAC Name: (2S)-2-amino-N-[(2S)-1-[(2S)-2-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-[[(1S)-2-phenyl-1-(1,3-thiazol-5-yl)ethyl]amino]propyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-N,3-dimethylbutanamide Traditional Name: (2S)-2-amino-N-[(1S)-1-[(2S)-2-[(2S)-2-[(1R,2R)-3-keto-1-methoxy-2-methyl-3-[[(1S)-2-phenyl-1-thiazol-5-yl-ethyl]amino]propyl]pyrrolidine-1-carbonyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]-N,3-dimethyl-butyramide Formula: C36H54N6O5S MolecularWeight: 682.91616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)C(C(C)C)C(=O)N1CCCC1C(=O)N2CCCC2C(C(C)C(=O)NC(CC3=CC=CC=C3)C4=CN=CS4)OC)N

Isomeric SMILES

C[C@H]([C@H]([C@@H]1CCCN1C(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N)OC)C(=O)N[C@@H](CC3=CC=CC=C3)C4=CN=CS4

InChI

InChI=1S/C36H54N6O5S/c1-22(2)30(37)35(45)40(6)31(23(3)4)36(46)42-18-12-16-28(42)34(44)41-17-11-15-27(41)32(47-7)24(5)33(43)39-26(29-20-38-21-48-29)19-25-13-9-8-10-14-25/h8-10,13-14,20-24,26-28,30-32H,11-12,15-19,37H2,1-7H3,(H,39,43)/t24-,26+,27+,28+,30+,31+,32-/m1/s1