5-[[4-(benzo[1,3]dioxol-5-ylmethyl)-2,3,5,6-tetrahydropyrazin-1-yl]sulfonyl]-N-(2,6-dimethylphenyl)-2-fluoro-benzamide

Molecular Formula: C27H29FN3O5S+


InChI: InChI=1/C27H28FN3O5S/c1-18-4-3-5-19(2)26(18)29-27(32)22-15-21(7-8-23(22)28)37(33,34)31-12-10-30(11-13-31)16-20-6-9-24-25(14-20)36-17-35-24/h3-9,14-15H,10-13,16-17H2,1-2H3,(H,29,32)/p+1/fC27H29FN3O5S/h29-30H/q+1

InChIKey: InChIKey=VXPMMYHPYCENJV-VZENYXHVCP
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5)F

Names:
    5-[[4-(benzo[1,3]dioxol-5-ylmethyl)-2,3,5,6-tetrahydropyrazin-1-yl]sulfonyl]-N-(2,6-dimethylphenyl)-2-fluoro-benzamide

Registries:
    PubChem CID 4088977
    PubChem ID 6007364