| Properties | Image |
MNX_ID | MNXM530569 |
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reference | chebi:95297 |
formula | C14H16N2OS |
global charge | 0 |
mol weight | 260.362 |
InChIKey | MTLJBAFNMHPGBV-UHFFFAOYSA-N |
InChI | InChI=1S/C14H16N2OS/c1-2-11-3-5-12(6-4-11)7-8-13(17)16-14-15-9-10-18-14/h3-8H,2,9-10H2,1H3,(H,15,16,17) |
SMILES | CCC1=CC=C(C=CC(=O)NC2=NCCS2)C=C1 |
MNX internals
InChI (mnx) | InChI=1/C14H16N2OS/c1-2-11-3-5-12(6-4-11)7-8-13(17)16-14-15-9-10-18-14/h3-8H,2,9-10H2,1H3,(H,15,16,17)/b8-7? |
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SMILES (mnx) | [CH3:1][CH2:2][C:11]1=[CH:4][CH:6]=[C:12]([CH:7]=[CH:8][C:13](=[N:16][C:14]2=[N:15][CH2:9][CH2:10][S:18]2)[OH:17])[CH:5]=[CH:3]1 |
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