HIT ID: HIT212661470
Cas No: 154323-57-6
分子式: C17H25N3O2S
分子量: 335.47
常用名: Almotriptan
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 1.5233824
IUPAC: dimethyl(2-{5-[(pyrrolidine-1-sulfonyl)methyl]-1H-indol-3-yl}ethyl)amine
IUPAC: dimethyl(2-{5-[(pyrrolidine-1-sulfonyl)methyl]-1H-indol-3-yl}ethyl)amine
SMILES: CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
SMILES: CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
InChI key: WKEMJKQOLOHJLZ-UHFFFAOYSA-N