NU5455
HIT214434626
sdf文件结构编辑类似物检索
HIT ID: HIT214434626
Cas No: 1257235-99-6
分子式: C34H33N3O5S
分子量: 595.71
常用名: NU5455
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-methyl-2-(morpholin-4-yl)-N-[10-(2-{8-oxa-3-azabicyclo[3.2.1]octan-3-yl}-4-oxo-4H-chromen-8-yl)-8-thiatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl]acetamide
IUPAC: N-methyl-2-(morpholin-4-yl)-N-[10-(2-{8-oxa-3-azabicyclo[3.2.1]octan-3-yl}-4-oxo-4H-chromen-8-yl)-8-thiatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl]acetamide
SMILES: CN(C(=O)CN1CCOCC1)c1ccc2sc3c(cccc3c2c1)-c1cccc2c1oc(cc2=O)N1CC2CCC(C1)O2
SMILES: CN(C(=O)CN1CCOCC1)c1ccc2sc3c(cccc3c2c1)-c1cccc2c1oc(cc2=O)N1CC2CCC(C1)O2
InChI key: NYHCXQIUWIEKQC-UHFFFAOYSA-N
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