Products 3061799-58-1

CAS 3061799-58-1 is the registry number for SARS-CoV-2 3CLpro-IN-32. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

S-(thiophen-2-ylmethylsulfanyl) (2S)-2-[[(2S)-3-cyclohexyl-2-(3-phenylprop-2-enoylamino)propanoyl]amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propanethioate (CAS 3061799-58-1) is a chemical compound with the molecular formula C30H37N3O4S3 and a molecular weight of 599.8 g/mol. IUPAC name: S-(thiophen-2-ylmethylsulfanyl) (2S)-2-[[(2S)-3-cyclohexyl-2-(3-phenylprop-2-enoylamino)propanoyl]amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propanethioate. InChIKey: MTGAPDARMZMRSF-RNXOBYDBSA-N.

Identity
Molecular formulaC30H37N3O4S3
Molecular weight599.8 g/mol
IUPAC nameS-(thiophen-2-ylmethylsulfanyl) (2S)-2-[[(2S)-3-cyclohexyl-2-(3-phenylprop-2-enoylamino)propanoyl]amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propanethioate
InChIKeyMTGAPDARMZMRSF-RNXOBYDBSA-N
SMILESC1CCC(CC1)C[C@@H](C(=O)N[C@@H](C[C@@H]2CCNC2=O)C(=O)SSCC3=CC=CS3)NC(=O)C=CC4=CC=CC=C4

Computed by PubChem (NCBI)

Synonyms: orb3027476