HIT ID: HIT107024569
Cas No: 333413-02-8
分子式: C21H19N5O4S2
分子量: 469.53
常用名: CA IX-IN-3
氢键受体数 (HBA): 9
氢键供体数 (HBD): 3
LogP: 2.749000000000000e+000
IUPAC: 2-methyl-5-{4-[(4-sulfamoylphenyl)amino]phthalazin-1-yl}benzene-1-sulfonamide
IUPAC: 2-methyl-5-{4-[(4-sulfamoylphenyl)amino]phthalazin-1-yl}benzene-1-sulfonamide
SMILES: Cc1ccc(cc1S(N)(=O)=O)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
SMILES: Cc1ccc(cc1S(N)(=O)=O)-c1nnc(Nc2ccc(cc2)S(N)(=O)=O)c2ccccc12
InChI key: VXNXKGJSGMZXLZ-UHFFFAOYSA-N
