HIT ID: HIT218851467
Cas No: 1956373-71-9
分子式: C26H20N6
分子量: 416.488
常用名: Bavtavirine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-[(4-amino-8-{4-[(1E)-2-cyanoeth-1-en-1-yl]-2,6-dimethylphenyl}quinazolin-2-yl)amino]benzonitrile
IUPAC: 4-[(4-amino-8-{4-[(1E)-2-cyanoeth-1-en-1-yl]-2,6-dimethylphenyl}quinazolin-2-yl)amino]benzonitrile
SMILES: Cc1cc(\C=C\C#N)cc(C)c1-c1cccc2c(N)nc(Nc3ccc(cc3)C#N)nc12
SMILES: Cc1cc(\C=C\C#N)cc(C)c1-c1cccc2c(N)nc(Nc3ccc(cc3)C#N)nc12
InChI key: HKETUZQMIFPGNG-SNAWJCMRSA-N