Products 1085706-72-4

CAS 1085706-72-4 is the registry number for Monooxazole (S,S)-Daclatasvir. Offered by: TRC. Available pack sizes: 100mg.

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

Methyl N-[(2S)-1-[(2S)-2-[5-[4-[4-[5-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-2-yl]phenyl]phenyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate (CAS 1085706-72-4) is a chemical compound with the molecular formula C40H49N7O7 and a molecular weight of 739.9 g/mol. IUPAC name: methyl N-[(2S)-1-[(2S)-2-[5-[4-[4-[5-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-2-yl]phenyl]phenyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate. InChIKey: DILSQRSXVJEYED-MKJGCKHTSA-N.

Identity
Molecular formulaC40H49N7O7
Molecular weight739.9 g/mol
IUPAC namemethyl N-[(2S)-1-[(2S)-2-[5-[4-[4-[5-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-2-yl]phenyl]phenyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
InChIKeyDILSQRSXVJEYED-MKJGCKHTSA-N
SMILESCC(C)[C@@H](C(=O)N1CCC[C@H]1C2=CN=C(N2)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CN=C(O5)[C@@H]6CCCN6C(=O)[C@H](C(C)C)NC(=O)OC)NC(=O)OC

Computed by PubChem (NCBI)