HIT ID: HIT214435883
Cas No: 2765676-81-9
分子式: C22H24F3N7OS
分子量: 491.54
常用名: CDK7-IN-18
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-{7-[(cyanoimino)(methyl)oxo-lambda6-sulfanyl]-1H-indol-3-yl}-N-[(3S)-6,6-dimethylpiperidin-3-yl]-5-(trifluoromethyl)pyrimidin-2-amine
IUPAC: 4-{7-[(cyanoimino)(methyl)oxo-lambda6-sulfanyl]-1H-indol-3-yl}-N-[(3S)-6,6-dimethylpiperidin-3-yl]-5-(trifluoromethyl)pyrimidin-2-amine
SMILES: CC1(C)CC[C@@H](CN1)Nc1ncc(c(n1)-c1c[nH]c2c(cccc12)S(C)(=O)=NC#N)C(F)(F)F
SMILES: CC1(C)CC[C@@H](CN1)Nc1ncc(c(n1)-c1c[nH]c2c(cccc12)S(C)(=O)=NC#N)C(F)(F)F
InChI key: KTVYKZXYJQGXFT-JKFVLOHPSA-N