HIT ID: HIT101494415

Cas No: 851304-36-4

分子式: C17H12N2O6S2

分子量: 404.41

常用名: KYA1797

氢键受体数 (HBA): 8

氢键供体数 (HBD): 1

LogP: 2.706000000000000e+000

IUPAC: 3-[(5Z)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

SMILES: OC(=O)CCN1C(=S)S\C(=C/c2ccc(o2)-c2ccc(cc2)[N+]([O-])=O)C1=O

InChI key: FNGXWOIGFSRSSD-ZROIWOOFSA-N