1-[8-[3-(carbamothioylamino)phenoxy]octyl]-3-(4-chlorophenyl)thiourea

Systemtic Name: 1-[8-[3-(carbamothioylamino)phenoxy]octyl]-3-(4-chlorophenyl)thiourea Openeye Name: 1-[8-[3-(carbamothioylamino)phenoxy]octyl]-3-(4-chlorophenyl)thiourea CAS Name: 1-[8-[3-(carbamothioylamino)phenoxy]octyl]-3-(4-chlorophenyl)thiourea IUPAC Name: 1-[8-[3-(carbamothioylamino)phenoxy]octyl]-3-(4-chlorophenyl)thiourea Traditional Name: 1-(4-chlorophenyl)-3-[8-(3-thioureidophenoxy)octyl]thiourea Formula: C22H29ClN4OS2 MolecularWeight: 465.07486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCCCCCNC(=S)NC2=CC=C(C=C2)Cl)NC(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCCCCCNC(=S)NC2=CC=C(C=C2)Cl)NC(=S)N

InChI

InChI=1S/C22H29ClN4OS2/c23-17-10-12-18(13-11-17)27-22(30)25-14-5-3-1-2-4-6-15-28-20-9-7-8-19(16-20)26-21(24)29/h7-13,16H,1-6,14-15H2,(H3,24,26,29)(H2,25,27,30)