DefNEtTrp
HIT219251235
sdf文件结构编辑类似物检索
HIT ID: HIT219251235
Cas No:
分子式: C30H27N9O3S
分子量: 593.67
常用名: DefNEtTrp
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-[2-({[(E)-[(3-aminopyridin-2-yl)methylidene]amino]carbamothioyl}amino)ethyl]-4-[3,5-bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl]benzamide
IUPAC: N-[2-({[(E)-[(3-aminopyridin-2-yl)methylidene]amino]carbamothioyl}amino)ethyl]-4-[3,5-bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl]benzamide
SMILES: Nc1cccnc1\C=N\NC(=S)NCCNC(=O)c1ccc(cc1)-n1nc(nc1-c1ccccc1O)-c1ccccc1O
SMILES: Nc1cccnc1\C=N\NC(=S)NCCNC(=O)c1ccc(cc1)-n1nc(nc1-c1ccccc1O)-c1ccccc1O
InChI key: HHVZDDSCXMKXTQ-MWBNBJEGSA-N
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