cis-bisulepin

Properties Image MNX_ID MNXM1135289 reference chebi:167624 formula C17H19NS2 global charge 0 mol weight 301.48 InChIKey ZLJLUTCIUOCIQM-NVNXTCNLSA-N InChI InChI=1S/C17H19NS2/c1-18(2)10-5-8-15-14-7-4-3-6-13(14)12-20-17-16(15)9-11-19-17/h3-4,6-9,11H,5,10,12H2,1-2H3/b15-8- SMILES CN(C)CC/C=C1/C2=C(C=CC=C2)CSC2=C1C=CS2 MNX internals InChI (mnx) InChI=1/C17H19NS2/c1-18(2)10-5-8-15-14-7-4-3-6-13(14)12-20-17-16(15)9-11-19-17/h3-4,6-9,11H,5,10,12H2,1-2H3/b15-8- SMILES (mnx) [CH3:1][N:18]([CH3:2])[CH2:10][CH2:5]/[CH:8]=[C:15]1/[C:14]2=[CH:7][CH:4]=[CH:3][CH:6]=[C:13]2[CH2:12][S:20][C:17]2=[C:16]1[CH:9]=[CH:11][S:19]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0