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1-(3-bromophenyl)-3-[8-[3-(carbamothioylamino)phenoxy]octyl]thiourea
1-(3-bromophenyl)-3-[8-[3-(carbamothioylamino)phenoxy]octyl]thiourea
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC(=C1)OCCCCCCCCNC(=S)NC2=CC(=CC=C2)Br)NC(=S)N
Isomeric SMILES
C1=CC(=CC(=C1)OCCCCCCCCNC(=S)NC2=CC(=CC=C2)Br)NC(=S)N
InChI
InChI=1S/C22H29BrN4OS2/c23-17-9-7-10-18(15-17)27-22(30)25-13-5-3-1-2-4-6-14-28-20-12-8-11-19(16-20)26-21(24)29/h7-12,15-16H,1-6,13-14H2,(H3,24,26,29)(H2,25,27,30)
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