Name: 2-{[2-(dimethylamino)ethyl]sulfanyl}-4-[(3-methyl-1,3-benzoxazol-2-ylidene)methyl]-1-phenyl-1lambda5-quinolin-1-ylium iodide
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HIT ID:HIT218852359
Cas No:172827-25-7,195199-08-7
常用名:2-{[2-(dimethylamino)ethyl]sulfanyl}-4-[(3-methyl-1,3-benzoxazol-2-ylidene)methyl]-1-phenyl-1lambda5-quinolin-1-ylium iodide
常用名:2-{[2-(dimethylamino)ethyl]sulfanyl}-4-[(3-methyl-1,3-benzoxazol-2-ylidene)methyl]-1-phenyl-1lambda5-quinolin-1-ylium iodide
IUPAC:2-{[2-(dimethylamino)ethyl]sulfanyl}-4-[(3-methyl-2,3-dihydro-1,3-benzoxazol-2-ylidene)methyl]-1-phenyl-1lambda5-quinolin-1-ylium iodide
IUPAC:2-{[2-(dimethylamino)ethyl]sulfanyl}-4-[(3-methyl-2,3-dihydro-1,3-benzoxazol-2-ylidene)methyl]-1-phenyl-1lambda5-quinolin-1-ylium iodide
InChI key:KQXBZZLQWLZPAL-UHFFFAOYSA-M

分子式:C28H28IN3OS
分子量:581.52
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[I-].CN(C)CCSc1cc(C=C2Oc3ccccc3N2C)c2ccccc2[n+]1-c1ccccc1
SMILES:[I-].CN(C)CCSc1cc(C=C2Oc3ccccc3N2C)c2ccccc2[n+]1-c1ccccc1

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