HIT ID: HIT218849394
Cas No:
分子式: C25H26ClNO6S
分子量: 508
常用名: cis-Clopidogrel-MP-13C-d3 Derivative
常用名: cis-Clopidogrel-MP-13C-d3 Derivative
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(3Z)-1-[1-(2-chlorophenyl)-2-methoxy-2-oxoethyl]-4-({2-[3-(13C,2H3)methoxyphenyl]-2-oxoethyl}sulfanyl)piperidin-3-ylidene]acetic acid
IUPAC: 2-[(3Z)-1-[1-(2-chlorophenyl)-2-methoxy-2-oxoethyl]-4-({2-[3-(13C,2H3)methoxyphenyl]-2-oxoethyl}sulfanyl)piperidin-3-ylidene]acetic acid
SMILES: [2H][13C]([2H])([2H])Oc1cccc(c1)C(=O)CSC1CCN(C\C1=C\C(O)=O)C(C(=O)OC)c1ccccc1Cl
SMILES: [2H][13C]([2H])([2H])Oc1cccc(c1)C(=O)CSC1CCN(C\C1=C\C(O)=O)C(C(=O)OC)c1ccccc1Cl
InChI key: FNCOEMFSIDGTAR-YUPPTRBSSA-N
